SCHEMBL8819795

SCHEMBL8819795

COC(=O)c1ccc(F)cc1Cc1ccc(C(=O)OC)c(C(F)S(=O)(=O)Cl)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.39
ALDH1A1 P00352 3/20 0.38
MAPT P10636 3/20 0.38
HPGD P15428 3/20 0.38
KDM4E B2RXH2 2/20 0.38
GAA P10253 1/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
HSD17B10 Q99714 1/20 0.38
PLA2G2A P14555 2/20 0.36
HSP90AA1 P07900 1/20 0.36
HSP90B1 P14625 1/20 0.36
ATM Q13315 1/20 0.35
POLB P06746 1/20 0.34
PSEN1 P49768 1/20 0.34
PSEN2 P49810 1/20 0.34
APH1B Q8WW43 1/20 0.34
NCSTN Q92542 1/20 0.34
APH1A Q96BI3 1/20 0.34
PSENEN Q9NZ42 1/20 0.34

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
SCHEMBL7696307 0.74 ALDH1A1 (0.43) FFAR4ALDH1A1MAPTHPGDKDM4E
SCHEMBL1741537 0.74 PLA2G2A (0.52) FFAR4ALDH1A1MAPTTSHRPLA2G2A
SCHEMBL12489097 0.70 FFAR4 (0.47) FFAR4ALDH1A1MAPTHPGDKDM4E
SCHEMBL8891670 0.70 PLA2G2A (0.50) FFAR4ALDH1A1MAPTHPGDKDM4E
SCHEMBL16958853 0.69 SLC6A4 (0.49) FFAR4ALDH1A1MAPTHPGDKDM4E
SCHEMBL364074 0.68 FFAR4 (0.48) FFAR4ALDH1A1MAPTHPGDKDM4E
SCHEMBL7703503 0.68 FFAR4 (0.45) FFAR4ALDH1A1MAPTHPGDKDM4E
SCHEMBL8747754 0.67 KMT2A (0.43) FFAR4ALDH1A1MAPTHPGDKDM4E
SCHEMBL22827958 0.67 CA1 (0.45) FFAR4ALDH1A1MAPTHPGDKDM4E
SCHEMBL21180877 0.67 ALDH1A1 (0.45) FFAR4ALDH1A1MAPTHPGDKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1997046207-A2 AROMATIC HETEROCYCLIC DERIVATIVES AS ENZYME INHIBITORS CORVAS INTERNATIONAL, INC. (US) 1997-12-11 WO disclosed