SCHEMBL8546642

SCHEMBL8546642

CCOC(=O)Cc1sc(SCc2ccncc2C(=O)OCc2ccccc2)nc1C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 1/20 0.40
RAB9A P51151 6/20 0.39
TSHR P16473 4/20 0.39
L3MBTL1 Q9Y468 3/20 0.39
CASP3 P42574 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
PRMT5 O14744 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
NPC1 O15118 3/20 0.38
ALDH1A1 P00352 3/20 0.38
KMT2A Q03164 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
NFKB1 P19838 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
LMNA P02545 1/20 0.38
MEN1 O00255 1/20 0.37
HSP90AA1 P07900 1/20 0.37

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
SCHEMBL8547337 0.91 ALDH1A1 (0.43) TRPM8RAB9ATSHRSMN1; SMN2NPC1
SCHEMBL8549517 0.87 ALDH1A1 (0.39) TRPM8RAB9AL3MBTL1SMN1; SMN2NPC1
SCHEMBL8545437 0.85 ALDH1A1 (0.38) RAB9ATSHRSMN1; SMN2NPC1ALDH1A1
SCHEMBL8545180 0.83 ALDH1A1 (0.43) TRPM8RAB9ATSHRSMN1; SMN2NPC1
SCHEMBL8546689 0.76 ALDH1A1 (0.43) RAB9ANPC1ALDH1A1KMT2ALMNA
SCHEMBL8546335 0.75 HSD17B10 (0.44) TRPM8TSHRL3MBTL1ALDH1A1KMT2A
SCHEMBL8543209 0.74 TRPM8 (0.42) TRPM8RAB9ATSHRL3MBTL1CASP3
SCHEMBL8663140 0.73 TRPM8 (0.46) TRPM8RAB9ATSHRL3MBTL1PRMT5
SCHEMBL8545401 0.73 TRPM8 (0.40) TRPM8RAB9ATSHRSMN1; SMN2NPC1
SCHEMBL10691483 0.71 FFAR1 (0.58) RAB9AL3MBTL1SMN1; SMN2NPC1ALDH1A1

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