SCHEMBL7601946

SCHEMBL7601946

CC(C)NC(Cc1ccccc1)C(=O)C(C)C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
ALDH1A1 P00352 1/20 0.46
THRB P10828 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
HSD17B10 Q99714 1/20 0.46
MME P08473 3/20 0.44
ACE P12821 2/20 0.44
CPA1 P15085 1/20 0.44
ACE2 Q9BYF1 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CYP1A2 P05177 1/20 0.44
LMNA P02545 1/20 0.44
CYP3A4 P08684 1/20 0.44
TSHR P16473 1/20 0.44
MMP9 P14780 1/20 0.43
MMP8 P22894 1/20 0.43
MMP14 P50281 1/20 0.43
LTA4H P09960 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL12766328 1.00 NPC1 (0.50) NPC1RAB9AALDH1A1THRBCYP2C9
SCHEMBL17943265 1.00 NPC1 (0.50) NPC1RAB9AALDH1A1THRBCYP2C9
SCHEMBL16171796 0.92 MME (0.54) ALDH1A1MMEACECPA1ACE2
SCHEMBL12411242 0.92 MME (0.54) ALDH1A1MMEACECPA1ACE2
SCHEMBL14009993 0.92 MME (0.54) ALDH1A1MMEACECPA1ACE2
SCHEMBL27271007 0.89 ALDH1A1 (0.50) NPC1RAB9AALDH1A1THRBCYP2C9
SCHEMBL14009996 0.88 ALDH1A1 (0.47) NPC1RAB9AALDH1A1MMEACE
SCHEMBL12411244 0.88 ALDH1A1 (0.47) NPC1RAB9AALDH1A1MMEACE
SCHEMBL123574 0.86 MME (0.58) NPC1RAB9AMMEACECPA1
SCHEMBL15592756 0.86 MME (0.58) NPC1RAB9AMMEACECPA1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 41 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240239828-A1 MANNOSE 6-PHOSPHATE OR ASGPR RECEPTOR BINDING COMPOUNDS FOR THE DEGRADATION OF EXTRACELLULAR PROTEINS AVILAR THERAPEUTICS, INC. (US) 2024-07-18 US disclosed
US-20240072809-A1 ASGPR-BINDING COMPOUNDS FOR THE DEGRADATION OF EXTRACELLULAR PROTEINS AVILAR THERAPEUTICS, INC. (US) 2024-02-29 US disclosed
EP-4309741-A1 CYCLIC COMPOUND HAVING INHIBITORY EFFECT SELECTIVE FOR KRAS BUT NOT FOR HRAS AND NRAS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-01-24 EP disclosed
WO-2023222558-A1 PRECURSOR AND THERANOSTIC RADIOTRACER WITH IMPROVED TUMOR RETENTION ZOUNEK ALEXIS NIKOLAI (DE) 2023-11-23 WO disclosed
US-11819551-B2 ASGPR-binding compounds for the degradation of extracellular proteins AVILAR THERAPEUTICS, INC. (US) 2023-11-21 US disclosed
US-20230331640-A1 PRODUCTION METHOD FOR RADIOLABELED ARYL COMPOUND OSAKA UNIVERSITY (JP) 2023-10-19 US disclosed
US-11731917-B2 Production method for radiolabeled aryl compound OSAKA UNIVERSITY (JP) 2023-08-22 US disclosed
US-20230233689-A1 Bifunctional Small Molecules to Target the Selective Degradation of Circulating Proteins UNIV YALE (US) 2023-07-27 US disclosed
US-20230233689-A1 Bifunctional Small Molecules to Target the Selective Degradation of Circulating Proteins UNIV YALE (US) 2023-07-27 US disclosed
US-11358985-B2 Tripeptide compound, preparation method therefor, and application thereof NORTHWEST UNIVERSITY (CN) 2022-06-14 US disclosed
US-8377865-B2 Peptidomimetics ; determine ability to bind to growth hormone secretagogue; ghrelin antagonist; appetite stimulation; dietetics ; weight maintenance; eating disorders IPSEN PHARMA S.A.S. (FR) 2013-02-19 US disclosed
US-8357654-B2 Multimeric CD40 ligands, method for preparing same and use thereof for preparing drugs CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2013-01-22 US disclosed
US-20120121675-A1 COMPOUNDS WHICH INHIBIT MUSCLE CONTRACTION LIPOTEC, S.A. (ES) 2012-05-17 US disclosed
US-20100196502-A1 Isoform Selective HDAC Inhibitors GEORGETOWN UNIVERSITY (US) 2010-08-05 US disclosed
US-20100183642-A1 NOVEL MULTIMERIC CD40 LIGANDS, METHOD FOR PREPARING SAME AND USE THEREOF FOR PREPARING DRUGS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2010-07-22 US disclosed
US-20100136034-A1 NOVEL MULTIMERIC MOLECULES, A PROCESS FOR PREPARING THE SAME AND THE USE THEREOF FOR MANUFACTURING MEDICINAL DRUGS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2010-06-03 US disclosed
US-20100130581-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OF PAIN THE UNIVERSITY OF QUEENSLAND 2010-05-27 US disclosed
US-7456253-B2 Peptidomimetics; determining ability to bind growth hormone secretagogue; ghrelin agonists; appetite stimulation; dietetics SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES, SAS (FR) 2008-11-25 US disclosed
US-20080242619-A1 Growth hormone releasing peptides BIOMEASURE, INCORPORATED 2008-10-02 US disclosed
US-7217794-B2 Compounds and methods for treatment of thrombosis DAIAMED, INC. (US) 2007-05-15 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (12 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11819551-B2 ASGPR-binding compounds for the degradation of extracellular proteins ASGR1, ENGASE, FCGR2A NPC1 1118/4885RAB9A 2323/4885ALDH1A1 3319/4885
US-20230331640-A1 PRODUCTION METHOD FOR RADIOLABELED ARYL COMPOUND NAT1, CAT, ARSA NPC1 749/4885RAB9A 621/4885ALDH1A1 817/4885
US-11731917-B2 Production method for radiolabeled aryl compound NAT1, CAT, ARSA NPC1 749/4885RAB9A 621/4885ALDH1A1 817/4885
US-20100183642-A1 NOVEL MULTIMERIC CD40 LIGANDS, METHOD FOR PREPARING SAME AND USE THEREOF FOR PREPARING DRUGS CD40, CD40LG, TNFSF10 NPC1 3716/4885RAB9A 4768/4885ALDH1A1 4708/4885
US-20080242619-A1 Growth hormone releasing peptides GHRHR, THRB, PRLHR NPC1 4192/4885RAB9A 2648/4885ALDH1A1 3712/4885
US-11358985-B2 Tripeptide compound, preparation method therefor, and application thereof VIP, PREP, ACE NPC1 1394/4885RAB9A 3258/4885ALDH1A1 3275/4885
US-20100136034-A1 NOVEL MULTIMERIC MOLECULES, A PROCESS FOR PREPARING THE SAME AND THE USE THEREOF FOR MANUFACTURING MEDICINAL DRUGS TNFRSF1A, TNFRSF9, CD40 NPC1 4400/4885RAB9A 3781/4885ALDH1A1 3689/4885
US-20230233689-A1 Bifunctional Small Molecules to Target the Selective Degradation of Circulating Proteins ASGR1, LDLR, FCGR2A NPC1 777/4885RAB9A 1780/4885ALDH1A1 3256/4885
US-20100130581-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OF PAIN OPRL1, CRH, OPRK1 NPC1 617/4885RAB9A 3909/4885ALDH1A1 2824/4885
US-20120121675-A1 COMPOUNDS WHICH INHIBIT MUSCLE CONTRACTION ATP2A3, MYLK2, MYL6 NPC1 4780/4885RAB9A 2734/4885ALDH1A1 4258/4885
US-20240239828-A1 MANNOSE 6-PHOSPHATE OR ASGPR RECEPTOR BINDING COMPOUNDS FOR THE DEGRADATION OF EXTRACELLULAR PROTEINS M6PR, ASGR1, IGF2R NPC1 2004/4885RAB9A 1579/4885ALDH1A1 4019/4885
US-20100196502-A1 Isoform Selective HDAC Inhibitors HDAC5, HDAC6, HDAC3 NPC1 1381/4885RAB9A 2546/4885ALDH1A1 1257/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.