SCHEMBL466340

SCHEMBL466340

O=C(O)C(Cc1c[nH]cn1)NCc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.40
MAPT P10636 1/20 0.40
POLB P06746 1/20 0.40
GPR142 Q7Z601 2/20 0.39
ALDH1A1 P00352 3/20 0.39
RAB9A P51151 1/20 0.39
PSMB5 P28074 1/20 0.38
KCNT1 Q5JUK3 1/20 0.37
MEP1B Q16820 2/20 0.37
MME P08473 1/20 0.37
NAALAD2 Q9Y3Q0 1/20 0.37

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
SCHEMBL466341 1.00 GAA (0.40) GAAMAPTPOLBGPR142ALDH1A1
SCHEMBL1643961 1.00 GAA (0.40) GAAMAPTPOLBGPR142ALDH1A1
Imidazole SCHEMBL11208968 0.91 GPR142 (0.38) GAAMAPTPOLBGPR142ALDH1A1
Imidazole SCHEMBL27561511 0.91 GPR142 (0.38) GAAMAPTPOLBGPR142ALDH1A1
Imidazole SCHEMBL9152956 0.91 GPR142 (0.38) GAAMAPTPOLBGPR142ALDH1A1
Imidazole SCHEMBL27609343 0.90 GPR142 (0.38) GAAMAPTPOLBGPR142ALDH1A1
SCHEMBL6384640 0.90 MC5R (0.39) GPR142
SCHEMBL6447871 0.87 SIRT2 (0.48) MAPTALDH1A1
SCHEMBL2059178 0.87 SIRT2 (0.48) MAPTALDH1A1
SCHEMBL147911 0.87 CPB2 (0.38) GPR142ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115209912-A Peptide compositions and methods of use thereof 杜兰教育基金管理者 2022-10-18 CN claimed
EP-3149029-B1 LIPIDATED PEPTIDES AS NEUROPROTECTIVE AGENTS USTAV ORGANICKE CHEMIE A BIOCHEMIE AV CR V V I (CZ) 2019-06-19 EP claimed
EP-3197874-B1 PROCESS FOR SYNTHESIZING ERGOTHIONEINE AND RELATED COMPOUNDS UNIV CAPE TOWN (ZA) 2019-04-24 EP claimed
CN-107108520-B Process for the synthesis of ergothioneine and related compounds 开普敦大学 2018-11-02 CN claimed
EP-3094643-B1 LIPIDATED PEPTIDES FOR LOWERING BLOOD GLUCOSE FYZIOLOGICKY USTAV AKADEMIE VED CESKE REPUBLIKY V V I (CZ) 2018-10-17 EP claimed
CN-107108520-A Process for the synthesis of ergothioneine and related compounds 开普敦大学 2017-08-29 CN claimed
EP-3149029-A1 LIPIDATED PEPTIDES AS NEUROPROTECTIVE AGENTS Ustav Organicke Chemie A Biochemie Av Cr, V.v.i. (CZ) 2017-04-05 EP claimed
US-20170051031-A1 LIPIDATED PEPTIDES AS NEUROPROTECTIVE AGENTS USTAV ORGANICKE CHEMIE A BIOCHEMIE AV CR, V.V.I. (CZ) 2017-02-23 US claimed
EP-3094643-A2 LIPIDATED PEPTIDES FOR LOWERING BLOOD GLUCOSE Fyziologicky Ústav Akademie VED Ceské Republiky, V.V.I. (CZ) 2016-11-23 EP claimed
US-20160331812-A1 LIPIDATED PEPTIDES AS ANTI-OBESITY AGENTS USTAV ORGANICKE CHEMIE A BIOCHEMIE AKADEMIE VED CR, V.V.I (CZ) 2016-11-17 US claimed
EP-1305334-A4 UROCORTIN PROTEINS AND USES THEREOF RES DEV FOUNDATION (US) 2005-03-23 EP claimed
EP-1305334-A1 UROCORTIN PROTEINS AND USES THEREOF RESEARCH DEVELOPMENT FOUNDATION (US) 2003-05-02 EP claimed
JP-2002512625-A 2002-04-23 JP claimed
WO-2002012307-A1 UROCORTIN PROTEINS AND USES THEREOF RESEARCH DEVELOPMENT FOUNDATION (US) 2002-02-14 WO claimed
EP-1001764-A1 HETEROCYCLIC AMIDE COMPOUNDS AS CELL ADHESION INHIBITORS Merck & Co., Inc. (a New Jersey corp.) (US) 2000-05-24 EP claimed
WO-1999064395-A1 HETEROCYCLIC AMIDE COMPOUNDS AS CELL ADHESION INHIBITORS MERCK & CO., INC. (US) 1999-12-16 WO claimed
WO-1998053814-A1 HETEROCYCLIC AMIDE COMPOUNDS AS CELL ADHESION INHIBITORS MERCK & CO., INC. (US) 1998-12-03 WO claimed
EP-0226304-B1 COMPOSITION CONTAINING A PENEM OR CARBAPENEM ANTIBIOTIC SANKYO COMPANY LIMITED (JP) 1991-08-28 EP claimed
US-4960881-A REACTING AMINO ACID WITH ALPHA-CHLORINATED CARBONATE IN SOLVENT IN PRESENCE OF ACID SCAVENGER SOCIETE NATIONALE DES POUDRES ET EXPLOSIFS (FR) 1990-10-02 US claimed
US-4691008-A COUPLING A URETHANE-BLOCKED TRIPEPTIDE AND A PEPTIDE WITH A FREE AMINE USING A CONDENSATION AGENT HOECHST AKTIENGESELLSCHAFT (DE) 1987-09-01 US claimed