SCHEMBL8423191

SCHEMBL8423191

N#Cc1cc(NS(=O)(=O)c2ccccc2)c(-c2ccc(F)cc2)nc1SCc1cccc(Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 3/20 0.45
NPSR1 Q6W5P4 1/20 0.45
ADORA1 P30542 3/20 0.44
MEN1 O00255 2/20 0.44
POLB P06746 2/20 0.44
KMT2A Q03164 2/20 0.44
ACLY P53396 2/20 0.42
LMNA P02545 3/20 0.41
TP53 P04637 1/20 0.41
MAPT P10636 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
SLC22A12 Q96S37 1/20 0.39
ALDH1A1 P00352 1/20 0.38
MALT1 Q9UDY8 2/20 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
SCHEMBL8419412 0.90 ALDH1A1 (0.43) NPSR1ADORA1MEN1KMT2AACLY
SCHEMBL8424588 0.86 TSHR (0.51) CCR2NPSR1ADORA1MEN1POLB
SCHEMBL8421622 0.84 ALDH1A1 (0.40) NPSR1ADORA1ACLYLMNATP53
SCHEMBL8421510 0.82 SLC22A12 (0.39) CCR2NPSR1MEN1POLBKMT2A
SCHEMBL8421498 0.81 ALDH1A1 (0.44) NPSR1MEN1POLBKMT2AACLY
SCHEMBL8519903 0.81 MAPT (0.41) ACLYLMNATP53MAPTSLC22A12
SCHEMBL8423226 0.80 ALDH1A1 (0.48) NPSR1MEN1POLBKMT2ALMNA
SCHEMBL8420124 0.79 ALDH1A1 (0.39) NPSR1MEN1KMT2AACLYLMNA
SCHEMBL8087346 0.79 MAPK13 (0.48) NPSR1ADORA1MEN1POLBKMT2A
SCHEMBL8095193 0.79 CNR1 (0.46) NPSR1ADORA1MEN1POLBKMT2A

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
US-5916905-A ANTIARTHRITIC AGENTS; ANALGESICS; ANTIPYRETICS G. D. SEARLE & CO. (US) 1999-06-29 US disclosed
US-5686470-A 2, 3-substituted pyridines for the treatment of inflammation WEIER RICHARD M (US) 1997-11-11 US disclosed