SCHEMBL9724077

SCHEMBL9724077

NC(=O)N(O)Cc1ccc(Sc2ccc(Cl)c(Cl)c2)s1

nearest known ligand 0.75

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 8/20 0.40
ICAM1 P05362 1/20 0.40
SELE P16581 1/20 0.40
USP7 Q93009 1/20 0.34
DHFR P00374 1/20 0.32
TYMS P04818 1/20 0.32

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
SCHEMBL9724079 0.86 ALOX5 (0.42) ALOX5ICAM1SELE
SCHEMBL9724082 0.84 ALOX5 (0.43) ALOX5USP7
SCHEMBL9373997 0.80 ALOX5 (0.54) ALOX5
SCHEMBL9724081 0.79 ALOX5 (0.43) ALOX5
SCHEMBL9724097 0.78 ALOX5 (0.41) ALOX5ICAM1SELE
SCHEMBL9251943 0.76 KDM4E (0.43) ALOX5
SCHEMBL9724091 0.73 DAO (0.35) ALOX5ICAM1SELEUSP7DHFR
SCHEMBL9724113 0.72 KDM4E (0.41) ALOX5USP7
SCHEMBL9373230 0.72 ALDH1A1 (0.53) ALOX5
SCHEMBL9474486 0.72 ALOX5 (0.46) ALOX5

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-5158971-A Antiallergens, antiinflammatory agents LILLY INDUSTRIES LIMITED (GB) 1992-10-27 US disclosed
EP-0459748-A2 Thien-2-yl methylurea derivatives as leukotriene inhibitors LILLY INDUSTRIES LIMITED (GB) 1991-12-04 EP disclosed