SCHEMBL6323586

SCHEMBL6323586

COC(=O)c1cccc(NC(=O)NS(=O)(=O)c2cccc(C)c2)c1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GPR17 Q13304 1/20 0.62
TCF4 P15884 1/20 0.57
CTNNB1 P35222 1/20 0.57
NLRP3 Q96P20 1/20 0.55
KCNA1 Q09470 1/20 0.53
KCNAB1 Q14722 1/20 0.53
FBP1 P09467 10/20 0.53
RAB9A P51151 3/20 0.53
NPC1 O15118 2/20 0.53
MAPT P10636 2/20 0.53
MEN1 O00255 1/20 0.52
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2D6 P10635 1/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52
KMT2A Q03164 1/20 0.52
IDH1 O75874 1/20 0.52
POLB P06746 1/20 0.51

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
SCHEMBL6323804 0.90 CA12 (0.57) NLRP3FBP1RAB9ANPC1MAPT
SCHEMBL1929592 0.90 FBP1 (0.53) GPR17NLRP3KCNA1KCNAB1FBP1
SCHEMBL6321981 0.89 TCF4 (0.73) GPR17TCF4CTNNB1RAB9ANPC1
SCHEMBL6326710 0.89 RAB9A (0.62) GPR17TCF4CTNNB1RAB9ANPC1
SCHEMBL1931132 0.88 FBP1 (0.54) NLRP3KCNA1KCNAB1FBP1RAB9A
SCHEMBL1929181 0.88 FBP1 (0.54) NLRP3KCNA1KCNAB1FBP1RAB9A
SCHEMBL6331726 0.88 MAPT (0.55) GPR17NLRP3KCNA1KCNAB1FBP1
SCHEMBL1928907 0.87 FBP1 (0.55) NLRP3KCNA1KCNAB1FBP1RAB9A
SCHEMBL6324631 0.87 ALDH1A1 (0.56) NLRP3KCNA1KCNAB1FBP1RAB9A
SCHEMBL1930806 0.87 FBP1 (0.55) NLRP3KCNA1KCNAB1FBP1RAB9A

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
US-6858565-B2 Thermosensitive recording material and novel color developer compounds OJI PAPER CO., LTD. (JP) 2005-02-22 US disclosed
US-20030040434-A1 Thermosensitive recording material and novel color developer compounds OJI PAPER CO., LTD. (JP) 2003-02-27 US disclosed
EP-1264707-A2 Thermosensitive recording material and novel color developer compounds OJI PAPER CO., LTD. (JP) 2002-12-11 EP disclosed