SCHEMBL8551330

SCHEMBL8551330

CCOC(=O)Cc1sc(Sc2ncccc2C(F)(F)F)nc1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 1/20 0.39
KDM4E B2RXH2 4/20 0.37
ALDH1A1 P00352 3/20 0.37
HPGD P15428 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
MAPT P10636 1/20 0.37
TP53 P04637 1/20 0.37
HTT P42858 1/20 0.37
HSD17B10 Q99714 1/20 0.37
GLA P06280 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
P2RY1 P47900 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
LMNA P02545 3/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
POLB P06746 1/20 0.35
GRM4 Q14833 1/20 0.35

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
SCHEMBL8548084 0.88 PPARD (0.39) KDM4EALDH1A1HPGDMAPTTP53
SCHEMBL8543410 0.85 TRPM8 (0.42) TRPM8KDM4EALDH1A1HPGDCYP1A2
SCHEMBL9035936 0.83 ALDH1A1 (0.46) TRPM8KDM4EALDH1A1CYP2C9MAPT
SCHEMBL8544938 0.83 ALDH1A1 (0.46) TRPM8KDM4EALDH1A1MAPTTP53
SCHEMBL8546712 0.81 L3MBTL1 (0.45) TRPM8KDM4EALDH1A1MAPTTP53
SCHEMBL8543496 0.81 TRPM8 (0.39) TRPM8KDM4EALDH1A1HPGDCYP1A2
SCHEMBL9036139 0.80 TRPM8 (0.37) TRPM8KDM4EALDH1A1HPGDMAPT
SCHEMBL8549346 0.79 LMNA (0.53) TRPM8KDM4EALDH1A1HPGDCYP1A2
SCHEMBL8545901 0.78 ALDH1A1 (0.43) TRPM8KDM4EALDH1A1CYP1A2CYP2C9
SCHEMBL8549230 0.78 TRPM8 (0.42) TRPM8ALDH1A1HPGDCYP1A2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0714393-B1 THIAZOLES AS ANTIVIRAL PFIZER (US) 1998-09-23 EP disclosed
US-5789408-A Antiviral thiazoles PFIZER INC. (US) 1998-08-04 US disclosed
WO-1995005378-A1 ANTIVIRAL THIAZOLES PFIZER INC. (US) 1995-02-23 WO disclosed