SCHEMBL9584734

SCHEMBL9584734

O=C(O)Cc1c(NCc2cccc(C(F)(F)F)c2)[nH]c2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 1/20 0.49
▸ FFAR4 Q5NUL3 1/20 0.49
▸ PARP14 Q460N5 1/20 0.48
▸ ALOX5 P09917 1/20 0.48
▸ CNR2 P34972 1/20 0.48
▸ RXFP1 Q9HBX9 2/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ APP P05067 2/20 0.46
▸ LMNA P02545 1/20 0.46
▸ MAPT P10636 3/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ MCL1 Q07820 1/20 0.45
▸ VNN1 O95497 1/20 0.45
▸ MAPK14 Q16539 1/20 0.45
▸ ALDH1A1 P00352 2/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ GAA P10253 1/20 0.44
▸ CASP1 P29466 1/20 0.44
▸ CASP7 P55210 1/20 0.44

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
Hydrochloric Acid SCHEMBL9583857 0.99 FFAR1 (0.48) FFAR1FFAR4PARP14ALOX5CNR2
SCHEMBL9583654 0.86 ALOX5 (0.61) ALOX5RXFP1APPMAPTMEN1
SCHEMBL9584429 0.77 MITF (0.49) LMNAMAPTMEN1KMT2AVNN1
SCHEMBL8174561 0.75 MCL1 (0.45) PARP14CNR2MAPTMEN1KMT2A
SCHEMBL9585369 0.74 EGFR (0.47) FFAR1FFAR4RXFP1L3MBTL1APP
SCHEMBL9583803 0.74 ALOX5 (0.67) ALOX5RXFP1APPMAPTMEN1
SCHEMBL9584177 0.74 MAPT (0.49) FFAR1FFAR4L3MBTL1APPLMNA
SCHEMBL9584139 0.74 CCR1 (0.50) FFAR1FFAR4RXFP1L3MBTL1APP
SCHEMBL22186997 0.74 CNR1 (0.50) PARP14CNR2RXFP1APPLMNA
SCHEMBL13168625 0.74 MCL1 (0.63) PARP14MAPTMCL1ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5245046-A α-amino-indole-3-acetic acids useful as anti-diabetic, anti-obesity and anti-atherosclerotic agents THE UPJOHN COMPANY (US) 1993-09-14 — — US claimed
EP-0375133-A1 Alpha-amino-indole-3-acetic acids useful as anti-diabetic, anti-obesity and anti-atherosclerotic agents THE UPJOHN COMPANY (US) 1990-06-27 — — EP claimed
WO-1990005721-A1 ALPHA-AMINO-INDOLE-3-ACETIC ACIDS USEFUL AS ANTI-DIABETIC, ANTI-OBESITY AND ANTI-ATHEROSCLEROTIC AGENTS THE UPJOHN COMPANY (US) 1990-05-31 — — WO claimed
US-5245046-A α-amino-indole-3-acetic acids useful as anti-diabetic, anti-obesity and anti-atherosclerotic agents THE UPJOHN COMPANY (US) 1993-09-14 — — US disclosed
EP-0375133-A1 Alpha-amino-indole-3-acetic acids useful as anti-diabetic, anti-obesity and anti-atherosclerotic agents THE UPJOHN COMPANY (US) 1990-06-27 — — EP disclosed
WO-1990005721-A1 ALPHA-AMINO-INDOLE-3-ACETIC ACIDS USEFUL AS ANTI-DIABETIC, ANTI-OBESITY AND ANTI-ATHEROSCLEROTIC AGENTS THE UPJOHN COMPANY (US) 1990-05-31 — — WO disclosed
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