SCHEMBL8545150

SCHEMBL8545150

CCOC(=O)Cc1sc(Sc2cc(C(=O)OC)nc3ccccc23)nc1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.43
TRPM8 Q7Z2W7 1/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
PKM P14618 1/20 0.41
NFKB1 P19838 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
KDM4E B2RXH2 2/20 0.40
POLB P06746 2/20 0.40
TOP2A P11388 2/20 0.40
MAPT P10636 2/20 0.39
KMT2A Q03164 2/20 0.39
ALDH1A1 P00352 2/20 0.39
LMNA P02545 1/20 0.39
PRNP P04156 2/20 0.38
RXFP1 Q9HBX9 2/20 0.38
ABCB1 P08183 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
SCHEMBL8551379 0.84 KDM4E (0.49) TRPM8NPC1RAB9AL3MBTL1PKM
SCHEMBL8550422 0.80 KDM4E (0.41) GAANPC1RAB9APKMSMN1; SMN2
SCHEMBL8547096 0.79 ALOX15 (0.42) PKMSMN1; SMN2KDM4EPOLBKMT2A
SCHEMBL8543398 0.74 TRPM8 (0.44) GAATRPM8NPC1RAB9AL3MBTL1
SCHEMBL8546712 0.74 L3MBTL1 (0.45) TRPM8NPC1RAB9AL3MBTL1PKM
SCHEMBL8548183 0.73 SMN1; SMN2 (0.43) TRPM8NPC1RAB9AL3MBTL1SMN1; SMN2
SCHEMBL8663874 0.73 TRPM8 (0.43) GAATRPM8NPC1RAB9AL3MBTL1
SCHEMBL8550254 0.72 TRPM8 (0.46) GAATRPM8NPC1RAB9AL3MBTL1
SCHEMBL8550467 0.72 CYP1A2 (0.50) GAATRPM8NPC1RAB9AL3MBTL1
SCHEMBL8549346 0.72 LMNA (0.53) TRPM8NPC1RAB9AL3MBTL1PKM

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 4 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
EP-0714393-A1 THIAZOLES AS ANTIVIRAL PFIZER INC. (US) 1996-06-05 EP disclosed
WO-1995005378-A1 ANTIVIRAL THIAZOLES PFIZER INC. (US) 1995-02-23 WO disclosed