SCHEMBL43876

SCHEMBL43876

N=C(CCC(=O)OC(=O)c1ccc(C=O)cc1)OC(=O)c1ccc(C=O)cc1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.49
KMT2A Q03164 4/20 0.41
PARP10 Q53GL7 1/20 0.38
PARP3 Q9Y6F1 1/20 0.38
ADRB2 P07550 1/20 0.38
ADRB1 P08588 1/20 0.38
ADRB3 P13945 1/20 0.38
ALDH5A1 P51649 1/20 0.33
ABAT P80404 1/20 0.33
KDM4E B2RXH2 2/20 0.33
MAPT P10636 2/20 0.33
EPHX2 P34913 1/20 0.32
NR1H4 Q96RI1 1/20 0.32
CYP2A6 P11509 2/20 0.31
UNG P13051 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
SCHEMBL18530060 0.98 ALDH1A1 (0.47) ALDH1A1KMT2APARP10PARP3ADRB2
SCHEMBL10810727 0.84 ALDH1A1 (0.39) ALDH1A1
SCHEMBL22173530 0.83 ALDH1A1 (0.54) ALDH1A1KMT2APARP10PARP3ADRB2
SCHEMBL17907572 0.81 NPC1 (0.42) KMT2AADRB2ADRB1ADRB3MAPT
SCHEMBL6307975 0.81 MAPT (0.40) ALDH1A1KMT2AMAPT
SCHEMBL8948561 0.81 TPMT (0.38)
SCHEMBL6754862 0.80 MAPK1 (0.46) ALDH1A1KMT2AKDM4EMAPT
SCHEMBL16553458 0.79 ALDH1A1 (0.46) ALDH1A1KMT2APARP10PARP3ADRB2
SCHEMBL28665174 0.78 ALDH1A1 (0.61) ALDH1A1KMT2APARP10PARP3ADRB2
SCHEMBL15515208 0.78 ELANE (0.46) ALDH1A1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10953073-B2 XTEN conjugate compositions and methods of making same AMUNIX PHARMACEUTICALS, INC. (US) 2021-03-23 US claimed
US-20180263927-A1 AFFINITY MEDICANT CONJUGATE AF CHEMICALS, LLC (US) 2018-09-20 US claimed
EP-2494075-B1 TEMPLATED NANOCONJUGATES UNIV NORTHWESTERN (US) 2018-04-04 EP claimed
EP-2714752-B1 METHODS FOR COUPLING TARGETING PEPTIDES ONTO RECOMBINANT LYSOSOMAL ENZYMES FOR IMPROVED TREATMENTS OF LYSOSOMAL STORAGE DISEASES AMICUS THERAPEUTICS INC (US) 2017-11-22 EP claimed
WO-2015032981-A1 ERYTHROPOIETIN CONJUGATES HAVING ORAL BIOAVAILABILITY LEK PHARMACEUTICALS D.D. (SI) 2015-03-12 WO claimed
EP-2227243-B1 A PHARMACEUTICAL COMPOSITION FOR TREATING OBESITY-RELATED DISEASE COMPRISING INSULINOTROPIC PEPTIDE CONJUGATE HANMI SCIENCE CO LTD (KR) 2014-08-13 EP claimed
US-8263084-B2 Pharmaceutical composition for treating obesity-related disease comprising insulinotropic peptide conjugate HANMI SCIENCE CO., LTD (KR) 2012-09-11 US claimed
EP-2494075-A2 TEMPLATED NANOCONJUGATES Northwestern University (US) 2012-09-05 EP claimed
US-20110257375-A1 INCREASING EFFICIENCY OF NUCLEIC ACID DELIVERY IN VIVO USING TARGETING CONJUGATES BIOO SCIENTIFIC CORPORATION 2011-10-20 US claimed
EP-2341916-A1 COLOSTRUM COMPOSITION Nanoko A/S (DK) 2011-07-13 EP claimed
EP-2249661-A2 PRODUCTS AND METHODS TO PREVENT INFECTION Multimerics APS (DK) 2010-11-17 EP claimed
WO-2010128793-A2 FAT SOLUBLE VITAMIN AND A DERIVATIVE THEREOF INDUCED BY NOVEL CATIONIC CHITOSAN, A METHOD OF PRODUCING SAME AND DRUG DELIVERY SYSTEM CONTAINING SAME 고려대학교 산학협력단 (KR) 2010-11-11 WO claimed
EP-2227243-A2 A PHARMACEUTICAL COMPOSITION FOR TREATING OBESITY-RELATED DISEASE COMPRISING INSULINOTROPIC PEPTIDE CONJUGATE Hanmi Pharmaceutical Co., Ltd. (KR) 2010-09-15 EP claimed
US-20100069814-A1 SYSTEM AND METHOD FOR UTILIZING MICROBUBBLES AND LIPOSOMES AS VIRAL SEQUESTERING AGENTS VERUS BIOTECHNOLOGY CORPORATION 2010-03-18 US claimed
WO-2010028652-A1 COLOSTRUM COMPOSITION NANOKO A/S (DK) 2010-03-18 WO claimed
US-20100003701-A1 COVALENT MODIFICATION AND CONJUGATION OF LUCIFERASE CARDIOGENICS INC. (CA) 2010-01-07 US claimed
US-20090311698-A1 DIAGNOSTIC ASSAY WAYNE STATE UNIVERSITY 2009-12-17 US claimed
WO-2009092383-A2 PRODUCTS AND METHODS TO PREVENT INFECTION MULTIMERICS APS (DK) 2009-07-30 WO claimed
WO-2009069983-A2 A PHARMACEUTICAL COMPOSITION FOR TREATING OBESITY-RELATED DISEASE COMPRISING INSULINOTROPIC PEPTIDE CONJUGATE HANMI PHARMACEUTICAL CO., LTD. (KR) 2009-06-04 WO claimed
US-20070254311-A1 Covalent modification and conjugation of luciferase CARDIOGENICS INC. (CA) 2007-11-01 US claimed

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

For each of this compound's patents that has machine-readable text (2 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-10953073-B2 XTEN conjugate compositions and methods of making same XPA, TXLNA, NGLY1 ALDH1A1 3685/4885KMT2A 2178/4885PARP10 701/4885
US-20180263927-A1 AFFINITY MEDICANT CONJUGATE FCER2, HDGF, FCGR2A ALDH1A1 3966/4885KMT2A 573/4885PARP10 1363/4885

“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.