SCHEMBL7846451

SCHEMBL7846451

Cc1csc(CC(=O)c2cccs2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 8/20 0.51
RAB9A P51151 8/20 0.51
ALDH1A1 P00352 3/20 0.51
LMNA P02545 3/20 0.51
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
POLB P06746 1/20 0.51
HPGD P15428 5/20 0.50
PKM P14618 1/20 0.50
TSHR P16473 1/20 0.50
MAPK1 P28482 1/20 0.50
HTT P42858 1/20 0.50
HSD17B10 Q99714 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
SMN1; SMN2 Q16637 4/20 0.49
GSK3B P49841 1/20 0.49
CTNNB1 P35222 2/20 0.47
WNT3A P56704 1/20 0.47
ERCC5 P28715 1/20 0.45
FEN1 P39748 1/20 0.45

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
SCHEMBL15979705 0.79 RAB9A (0.68) NPC1RAB9AALDH1A1LMNAMEN1
Methyl Alcohol SCHEMBL27628003 0.78 RAB9A (0.60) NPC1RAB9AALDH1A1LMNAMEN1
SCHEMBL9049816 0.78 RAB9A (0.64) NPC1RAB9AALDH1A1LMNAMEN1
SCHEMBL6168851 0.78 RAB9A (0.47) NPC1RAB9AALDH1A1LMNAMEN1
SCHEMBL7832355 0.76 NPC1 (0.47) NPC1RAB9AALDH1A1LMNAMEN1
SCHEMBL7846518 0.75 CES2 (0.43) NPC1RAB9AMEN1KMT2AHPGD
SCHEMBL7843406 0.75 CTNNB1 (0.47) NPC1RAB9AMEN1KMT2AL3MBTL1
SCHEMBL27942177 0.74 DAO (0.47) NPC1RAB9AALDH1A1MEN1KMT2A
SCHEMBL7847516 0.73 RAB9A (0.49) NPC1RAB9AALDH1A1LMNAMEN1
SCHEMBL7832513 0.73 CTNNB1 (0.44) NPC1RAB9AALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1125932-A2 Substituted thiazoles for the treatment of inflammation G.D. SEARLE & CO. (US) 2001-08-22 EP disclosed