SCHEMBL2858374

SCHEMBL2858374

Cc1cccc(C(N)CC(=O)O)c1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
CYP26A1 O43174 1/20 0.48
ANPEP P15144 1/20 0.46
ENPEP Q07075 1/20 0.46
ACP3 P15309 1/20 0.46
CTSA P10619 3/20 0.45
SLC6A9 P48067 1/20 0.44
GABBR2 O75899 1/20 0.43
GABBR1 Q9UBS5 1/20 0.43
PARP1 P09874 1/20 0.42
ATM Q13315 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
KIF11 P52732 3/20 0.41
FFAR1 O14842 1/20 0.41
MGAM O43451 1/20 0.41
GAA P10253 1/20 0.41
SI P14410 1/20 0.41
MGAM2 Q2M2H8 1/20 0.41

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
SCHEMBL3510648 1.00 KMT2A (0.55) KMT2ASMN1; SMN2CYP26A1ANPEPENPEP
SCHEMBL27347770 1.00 KMT2A (0.55) KMT2ASMN1; SMN2CYP26A1ANPEPENPEP
SCHEMBL20545820 0.91 CTSA (0.56) KMT2ASMN1; SMN2CYP26A1ANPEPENPEP
SCHEMBL20545819 0.91 CTSA (0.56) KMT2ASMN1; SMN2CYP26A1ANPEPENPEP
SCHEMBL20546802 0.88 KMT2A (0.54) KMT2ASMN1; SMN2CYP26A1ANPEPENPEP
SCHEMBL20546800 0.88 KMT2A (0.54) KMT2ASMN1; SMN2CYP26A1ANPEPENPEP
SCHEMBL14432240 0.86 PARP1 (0.46) KMT2ASMN1; SMN2CYP26A1ANPEPENPEP
Hydrochloric Acid SCHEMBL20546996 0.85 KMT2A (0.59) KMT2ASMN1; SMN2CYP26A1L3MBTL1FFAR1
Hydrochloric Acid SCHEMBL20546995 0.85 KMT2A (0.59) KMT2ASMN1; SMN2CYP26A1L3MBTL1FFAR1
SCHEMBL4931341 0.83 SLC6A9 (0.45) KMT2ASMN1; SMN2CYP26A1ANPEPENPEP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4023624-A1 HETERODIMERS OF GLUTAMIC ACID Molecular Insight Pharmaceuticals, Inc. (US) 2022-07-06 EP disclosed
EP-3699162-B1 HETERODIMERS OF GLUTAMIC ACID MOLECULAR INSIGHT PHARM INC (US) 2022-06-29 EP disclosed
US-20210246103-A1 HETERODIMERS OF GLUTAMIC ACID CITIZENS BANK, N.A. 2021-08-12 US disclosed
US-20210070695-A1 HETERODIMERS OF GLUTAMIC ACID MOLECULAR INSIGHT PHARMACEUTICALS, INC. 2021-03-11 US disclosed
US-20210070696-A1 HETERODIMERS OF GLUTAMIC ACID MOLECULAR INSIGHT PHARMACEUTICALS, INC. 2021-03-11 US disclosed
EP-3335736-B1 HETERODIMERS OF GLUTAMIC ACID MOLECULAR INSIGHT PHARM INC (US) 2020-12-30 EP disclosed
US-10647666-B2 Heterodimers of glutamic acid MOLECULAR INSIGHT PHARMACEUTICALS, INC. (US) 2020-05-12 US disclosed
US-10640461-B2 Heterodimers of glutamic acid MOLECULAR INSIGHT PHARMACEUTICALS, INC. (US) 2020-05-05 US disclosed
US-20190276393-A1 Heterodimers of Glutamic Acid MOLECULAR INSIGHT PHARMACEUTICALS, INC. (US) 2019-09-12 US disclosed
EP-2942065-B1 HETERODIMERS OF GLUTAMIC ACID MOLECULAR INSIGHT PHARM INC (US) 2018-06-27 EP disclosed
US-7501429-B2 Pyrimidine compounds as anti-ictogenic and/or anti-epileptogenic agents QUEEN'S UNIVERSITY AT KINGSTON (CA) 2009-03-10 US disclosed
US-7268164-B2 Anti-epileptogenic agents QUEENS UNIVERSITY AT KINGSTON (CA) 2007-09-11 US disclosed
US-7268164-B2 Anti-epileptogenic agents QUEENS UNIVERSITY AT KINGSTON (CA) 2007-09-11 US disclosed
US-7157454-B2 Derivatives of n-(arylsulfonyl)beta-aminoacids comprising a substituted aminomethyl group, the preparation method thereof and the pharmaceutical compositions containing same SANOFI-AVENTIS (FR) 2007-01-02 US disclosed
US-20060178433-A1 3-Amino-3-arylpropionic acid n-alkyl esters, process for production thereof, and process for production of optically active 3-amino-3-arylpropionic acids and esters of the antipodes thereto UBE INDUSTRIES, LTD. (JP) 2006-08-10 US disclosed
EP-1621529-A1 3-AMINO-3-ARYLPROPIONIC ACID n-ALKYL ESTERS, PROCESS FOR PRODUCTION THEREOF, AND PROCESS FOR PRODUCTION OF OPTICALLY ACTIVE 3-AMINO-3-ARYLPROPIONIC ACIDS AND ESTERS OF THE ANTIPODES THERETO Ube Industries, Ltd. (JP) 2006-02-01 EP disclosed
US-20040116353-A1 Derivatives of n-(arylsulfonyl)beta-aminoacids comprising a substituted aminomethyl group, the preparation method thereof and the pharmaceutical compositions containing same SANOFI (FR) 2004-06-17 US disclosed
US-6667334-B1 Inhibitors of adhesion and migration of leukocytes and/or antagonists of adhesion receptor VLA-4 belonging to integrins group AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2003-12-23 US disclosed
EP-1077994-A1 IMIDAZOLIDINE DERIVATIVES, THE PRODUCTION THEREOF, THEIR USE AND PHARMACEUTICAL PREPARATIONS CONTAINING THE SAME Aventis Pharma Deutschland GmbH (DE) 2001-02-28 EP disclosed
WO-1999060015-A1 IMIDAZOLIDINE DERIVATIVES, THE PRODUCTION THEREOF, THEIR USE AND PHARMACEUTICAL PREPARATIONS CONTAINING THE SAME AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 1999-11-25 WO 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 (7 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-20210070695-A1 HETERODIMERS OF GLUTAMIC ACID DDO, GLUL, ASNS KMT2A 2413/4885SMN1; SMN2 3022/4885CYP26A1 1134/4885
US-20190276393-A1 Heterodimers of Glutamic Acid GLUL, DDO, ASNS KMT2A 2234/4885SMN1; SMN2 2996/4885CYP26A1 1528/4885
US-10647666-B2 Heterodimers of glutamic acid DDO, GLUL, ASNS KMT2A 2413/4885SMN1; SMN2 3022/4885CYP26A1 1134/4885
US-20060178433-A1 3-Amino-3-arylpropionic acid n-alkyl esters, process for production thereof, and process for production of optically active 3-amino-3-arylpropionic acids and esters of the antipodes thereto ALAD, ARSA, ALDH7A1 KMT2A 4127/4885SMN1; SMN2 3856/4885CYP26A1 94/4885
US-20210070696-A1 HETERODIMERS OF GLUTAMIC ACID DDO, GLUL, ASNS KMT2A 2402/4885SMN1; SMN2 2993/4885CYP26A1 1150/4885
US-10640461-B2 Heterodimers of glutamic acid DDO, GLUL, ASNS KMT2A 2413/4885SMN1; SMN2 3022/4885CYP26A1 1134/4885
US-20210246103-A1 HETERODIMERS OF GLUTAMIC ACID DDO, GLUL, ASNS KMT2A 2413/4885SMN1; SMN2 3022/4885CYP26A1 1134/4885

“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.