SCHEMBL8545401

SCHEMBL8545401

CCOC(=O)Cc1sc(Sc2ccncc2C(=O)O)nc1C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 1/20 0.40
CDC7 O00311 6/20 0.37
DBF4 Q9UBU7 6/20 0.37
ALDH1A1 P00352 3/20 0.35
HSD17B10 Q99714 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
TSHR P16473 2/20 0.34
USP2 O75604 1/20 0.34
MAPK1 P28482 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 2/20 0.34
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
KDM4E B2RXH2 1/20 0.34
HPGD P15428 1/20 0.34
NFKB1 P19838 1/20 0.34
STAT1 P42224 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
CYP1A2 P05177 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
SCHEMBL8549489 0.85 SMN1; SMN2 (0.35) TRPM8CDC7DBF4ALDH1A1HSD17B10
SCHEMBL8549517 0.83 ALDH1A1 (0.39) TRPM8CDC7DBF4ALDH1A1HSD17B10
SCHEMBL9035936 0.80 ALDH1A1 (0.46) TRPM8ALDH1A1HSD17B10SMN1; SMN2MAPK1
SCHEMBL8590103 0.78 CDC7 (0.38) CDC7DBF4ALDH1A1HSD17B10SMN1; SMN2
SCHEMBL8590107 0.78 CDC7 (0.38) CDC7DBF4ALDH1A1HSD17B10SMN1; SMN2
SCHEMBL8547337 0.77 ALDH1A1 (0.43) TRPM8CDC7DBF4ALDH1A1HSD17B10
SCHEMBL8545588 0.75 TRPM8 (0.41) TRPM8CDC7DBF4ALDH1A1HSD17B10
SCHEMBL8545180 0.75 ALDH1A1 (0.43) TRPM8CDC7DBF4ALDH1A1HSD17B10
SCHEMBL8550254 0.74 TRPM8 (0.46) TRPM8ALDH1A1HSD17B10SMN1; SMN2TSHR
SCHEMBL8546642 0.73 TRPM8 (0.40) TRPM8ALDH1A1HSD17B10SMN1; SMN2TSHR

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