SCHEMBL6947073

SCHEMBL6947073

O=C(O)/C=C/C(=O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.64
ALDH1A1 P00352 4/20 0.64
KMT2A Q03164 3/20 0.64
HPGD P15428 2/20 0.62
LMNA P02545 1/20 0.62
THRB P10828 1/20 0.62
HTT P42858 1/20 0.62
NPSR1 Q6W5P4 1/20 0.62
GPR52 Q9Y2T5 1/20 0.57
KDM4E B2RXH2 1/20 0.55
RAB9A P51151 3/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
HSP90AA1 P07900 2/20 0.54
MEN1 O00255 2/20 0.54
NPC1 O15118 2/20 0.54
USP2 O75604 1/20 0.54
POLB P06746 1/20 0.54
ALOX12 P18054 1/20 0.54
MAPK1 P28482 1/20 0.54
CYP1A1 P04798 1/20 0.53

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
SCHEMBL6947075 1.00 MAPT (0.64) MAPTALDH1A1KMT2AHPGDLMNA
SCHEMBL14124738 1.00 MAPT (0.64) MAPTALDH1A1KMT2AHPGDLMNA
SCHEMBL14124718 1.00 MAPT (0.64) MAPTALDH1A1KMT2AHPGDLMNA
SCHEMBL312429 0.87 ALDH1A1 (0.68) MAPTALDH1A1KMT2AHPGDLMNA
SCHEMBL312430 0.87 ALDH1A1 (0.68) MAPTALDH1A1KMT2AHPGDLMNA
SCHEMBL5585936 0.87 ALDH1A1 (0.68) MAPTALDH1A1KMT2AHPGDLMNA
SCHEMBL10876318 0.85 ALDH1A1 (0.65) MAPTALDH1A1KMT2AHPGDLMNA
Biphenyl SCHEMBL5421614 0.84 ALDH1A1 (0.63) MAPTALDH1A1KMT2AHPGDLMNA
Biphenyl SCHEMBL9816554 0.84 ALDH1A1 (0.63) MAPTALDH1A1KMT2AHPGDLMNA
Biphenyl SCHEMBL28611778 0.84 ALDH1A1 (0.63) MAPTALDH1A1KMT2AHPGDLMNA

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0902011-B1 GAMMA-OXO-HOMOPHENYLALANINE DERIVATIVES AND PROCESS FOR PRODUCING HOMOPHENYLALANINE DERIVATIVES BY REDUCING THE SAME KANEKA CORP (JP) 2003-05-21 EP disclosed
US-5981794-A REACTING A BETA-BENZOYLACRYLIC ACID DERIVATIVE WITH A 1-ARYLETHYLAMINE DERIVATIVE KANEKA CORPORATION (JP) 1999-11-09 US disclosed
EP-0902011-A1 $g(g)-OXO-HOMOPHENYLALANINE DERIVATIVES AND PROCESS FOR PRODUCING HOMOPHENYLALANINE DERIVATIVES BY REDUCING THE SAME Kaneka Corporation (JP) 1999-03-17 EP disclosed
US-4511575-A Antidiabetic pyrrolecarboxylic acids PFIZER INC. (US) 1985-04-16 US disclosed
US-4511576-A Antidiabetic pyrrolecarboxylic acids PFIZER INC. (US) 1985-04-16 US disclosed
US-4351843-A LOWERING BLOOD GLUCOSE PFIZER INC. (US) 1982-09-28 US disclosed
US-4282242-A HYPOGLYCEMIC AGENTS PFIZER INC. (US) 1981-08-04 US disclosed
US-4021479-A ANTIPHLOGISTICS AND ANTIPROLIFERATIVES BOEHRINGER INGELHEIM GMBH (DT) 1977-05-03 US disclosed
US-3931159-A BACTERICIDE AMERICAN HOME PRODUCTS CORPORATION (US) 1976-01-06 US disclosed