SCHEMBL8546335

SCHEMBL8546335

CCOC(=O)Cc1sc(SCc2ncccc2C(=O)OCC)nc1C

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 4/20 0.44
ALDH1A1 P00352 3/20 0.44
MAPT P10636 5/20 0.43
HTT P42858 3/20 0.43
KDM4E B2RXH2 2/20 0.43
MAPK1 P28482 1/20 0.40
TP53 P04637 2/20 0.39
HPGD P15428 1/20 0.39
TRPM8 Q7Z2W7 1/20 0.39
USP2 O75604 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
LMNA P02545 2/20 0.39
TSHR P16473 1/20 0.38
ALOX15 P16050 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL8544938 0.85 ALDH1A1 (0.46) HSD17B10ALDH1A1MAPTHTTKDM4E
SCHEMBL8547337 0.80 ALDH1A1 (0.43) HSD17B10ALDH1A1MAPTHTTKDM4E
SCHEMBL8545180 0.80 ALDH1A1 (0.43) HSD17B10ALDH1A1MAPTHTTKDM4E
SCHEMBL8546674 0.79 SMN1; SMN2 (0.42) HSD17B10ALDH1A1MAPTHTTKDM4E
SCHEMBL8546712 0.79 L3MBTL1 (0.45) HSD17B10ALDH1A1MAPTHTTKDM4E
SCHEMBL9035936 0.79 ALDH1A1 (0.46) HSD17B10ALDH1A1MAPTHTTKDM4E
SCHEMBL8543410 0.78 TRPM8 (0.42) HSD17B10ALDH1A1MAPTHTTKDM4E
SCHEMBL10515633 0.78 MAPT (0.60) HSD17B10ALDH1A1MAPTHTTMAPK1
SCHEMBL8543496 0.77 TRPM8 (0.39) HSD17B10ALDH1A1MAPTHTTKDM4E
SCHEMBL8549346 0.75 LMNA (0.53) HSD17B10ALDH1A1MAPTHTTKDM4E

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