SCHEMBL20775422

SCHEMBL20775422

COc1cccc(OC)c1NC(=O)NS(=O)(=O)/C=C/c1nccs1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 7/20 0.61
RAB9A P51151 4/20 0.40
NPC1 O15118 3/20 0.40
ADRB2 P07550 1/20 0.40
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
MAPK1 P28482 2/20 0.39
POLB P06746 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
GAA P10253 2/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
TDP1 Q9NUW8 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
SCHEMBL20782934 0.79 NLRP3 (0.74) NLRP3
SCHEMBL20782915 0.77 NLRP3 (0.55) NLRP3RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL20775419 0.76 NLRP3 (1.00) NLRP3
SCHEMBL20783123 0.74 NLRP3 (0.65) NLRP3RAB9ANPC1
SCHEMBL20782977 0.74 NLRP3 (0.59) NLRP3SMN1; SMN2
SCHEMBL20775414 0.74 NLRP3 (0.65) NLRP3KDM4EHPGD
SCHEMBL20783097 0.74 NLRP3 (1.00) NLRP3
SCHEMBL20783076 0.73 NLRP3 (0.53) NLRP3MEN1KMT2AMAPK1POLB
SCHEMBL20188746 0.70 GRM4 (0.52) RAB9ANPC1ADRB2MEN1KMT2A
SCHEMBL20207639 0.65 GAA (0.41) RAB9ANPC1ADRB2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019043610-A1 NOVEL SUBSTITUTED SULFONYLUREA DERIVATIVES CADILA HEALTHCARE LIMITED (IN) 2019-03-07 WO disclosed
WO-2019043610-A1 NOVEL SUBSTITUTED SULFONYLUREA DERIVATIVES CADILA HEALTHCARE LIMITED (IN) 2019-03-07 WO disclosed