SCHEMBL729006

SCHEMBL729006

C[N+]1(CCN=C=NC2CCCCC2)CCOCC1

nearest known ligand 0.68

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.68
CYP1A2 P05177 1/20 0.54
EPHX1 P07099 1/20 0.40
HIF1A Q16665 1/20 0.40
HPGD P15428 1/20 0.35
ALOX15 P16050 1/20 0.35
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL17529572 0.85 CYP2C9 (0.53) CYP2C9CYP1A2EPHX1HIF1A
SCHEMBL6533548 0.82 CYP2C9 (1.00) CYP2C9CYP1A2ALDH1A1
SCHEMBL2534752 0.82 CYP2C9 (0.84) CYP2C9CYP1A2ALDH1A1
SCHEMBL3422484 0.78 CYP2C9 (0.89) CYP2C9CYP1A2ALDH1A1
SCHEMBL14064577 0.75 ALDH1A1 (0.45) CYP2C9CYP1A2ALDH1A1
SCHEMBL2049555 0.73 EPHX1 (0.67) CYP2C9CYP1A2EPHX1HIF1AALDH1A1
SCHEMBL1821144 0.72 CYP2C9 (0.42) CYP2C9CYP1A2HPGDALOX15
SCHEMBL8716044 0.72 CYP2C9 (0.39) CYP2C9HPGDALOX15
SCHEMBL14064581 0.72 CYP2C9 (0.40) CYP2C9HPGDALOX15
SCHEMBL18905783 0.71 CYP2C9 (0.38) CYP2C9HPGDALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2566845-B1 CONJUGATION REACTIONS INNOVA BIOSCIENCES LTD (GB) 2017-05-24 EP claimed
US-8877892-B2 Conjugation reactions INNOVA BIOSCIENCES LIMITED (GB) 2014-11-04 US claimed
EP-2123328-B1 Galanthamine derivatives, methods for their obtaining and use SOPHARMA AD (BG) 2011-05-04 EP claimed
EP-2123328-A1 Galanthamine derivatives, methods for their obtaining and use Sopharma AD (BG) 2009-11-25 EP claimed
EP-0611774-B1 Production of amides and peptides without racemization in the presence of catalytic amounts of a N-hydroxy-compound HOFFMANN LA ROCHE (CH) 1999-05-26 EP claimed
EP-4655073-A2 CEREBLON-BASED KRAS DEGRADING PROTACS ANS USES RELATED THERETO Arvinas Operations, Inc. (US) 2025-12-03 EP disclosed
US-12448399-B2 Cereblon-based KRAS degrading PROTACs and uses related thereto ARVINAS OPERATIONS, INC. (US) 2025-10-21 US disclosed
WO-2024159164-A2 CEREBLON-BASED KRAS DEGRADING PROTACS ANS USES RELATED THERETO ARVINAS OPERATIONS, INC. (US) 2024-08-02 WO disclosed
WO-2023230604-A2 METHODS OF PREPARING RNA SAMPLES FOR SEQUENCING, METHODS OF SEQUENCING RNA, AND METHODS OF PREPARING RNA MOLECULES WITH MODIFIED MUCLEIC ACIDS THOMAS JEFFERSON UNIVERSITY (US) 2023-11-30 WO disclosed
US-11782062-B2 Kits for analysis using nucleic acid encoding and/or label Encodia, Inc. (US) 2023-10-10 US disclosed
US-11782062-B2 Kits for analysis using nucleic acid encoding and/or label Encodia, Inc. (US) 2023-10-10 US disclosed
US-20230220589-A1 POLYPEPTIDE TERMINAL BINDERS AND USES THEREOF Encodia, Inc. (US) 2023-07-13 US disclosed
EP-0031722-B1 WATER SOLUBLE GUANIDINE DERIVATIVES OF POLYENE MACROLIDES AND THE ESTERS THEREOF, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM A/S Dumex (Dumex Ltd.) (DK) 1984-03-28 EP disclosed
EP-0004512-B1 MURAMYL-PEPTIDE ESTER DERIVATIVES AND THEIR APPLICATION TO PHARMACOLOGICAL COMPOSITIONS AND LABORATORY REACTANTS ANVAR Agence Nationale de Valorisation de la Recherche (FR) 1984-01-18 EP disclosed
US-4396607-A IMMUNOLOGY, ANTIGENS AGENCE NATIONALE DE VALORISATION DE LA RECHERCHE (ANVAR) (FR) 1983-08-02 US disclosed
US-4351902-A Production of 2-keto-D-gluconic acid and hydrogen peroxide CETUS CORPORATION (US) 1982-09-28 US disclosed
US-4284723-A HALOHYDRIN FORMATION WITH HALOGENATING ENZYME, OXIDIZER, HALIDE ION CETUS CORPORATION (US) 1981-08-18 US disclosed
US-4247641-A USING A HALOGENATING ENZYME, AN OXIDIZER, AND A HALIDE ION SOURCE TO OBTAIN THE HALOHYDRIN INTERMEDIATE CETUS CORPORATION (US) 1981-01-27 US disclosed
WO-1979000802-A1 NEW ESTER COMPOUNDS OF MURAMYL-PEPTIDE AND APPLICATIONS THEREOF TO PHARMACEUTICAL COMPOSITIONS AND LABORATORY REACTA ANVAR (FR) 1979-10-18 WO disclosed
EP-0004512-A1 Muramyl-peptide ester derivatives and their application to pharmacological compositions and laboratory reactants ANVAR Agence Nationale de Valorisation de la Recherche (FR) 1979-10-03 EP 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 (1 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-12448399-B2 Cereblon-based KRAS degrading PROTACs and uses related thereto CRBN, KRAS, WEE1 CYP2C9 4176/4885CYP1A2 4381/4885EPHX1 1095/4885

“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.