SCHEMBL9764819

SCHEMBL9764819

NC(=O)N(O)CC(c1cccc2sccc12)c1cccc2sccc12

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 8/20 0.43
SYK P43405 1/20 0.37
CSNK2A2 P19784 1/20 0.34
CSNK2B P67870 1/20 0.34
CSNK2A1 P68400 1/20 0.34
BCAT2 O15382 1/20 0.32
OPRM1 P35372 1/20 0.32
OPRK1 P41145 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
SCHEMBL9764840 0.82 ALOX5 (0.60) ALOX5
SCHEMBL10928021 0.76 ALOX5 (0.36) ALOX5SYKCSNK2A2CSNK2BCSNK2A1
SCHEMBL20889266 0.74 ALOX5 (0.42) ALOX5SYKCSNK2A2CSNK2BCSNK2A1
SCHEMBL19682602 0.74 ALOX5 (0.42) ALOX5SYKCSNK2A2CSNK2BCSNK2A1
SCHEMBL9764889 0.73 ALOX5 (0.41) ALOX5
SCHEMBL10927783 0.72 ALOX5 (0.35) ALOX5SYKCSNK2A2CSNK2BCSNK2A1
SCHEMBL10367027 0.71 CXCL8 (0.41) ALOX5CSNK2A2CSNK2BCSNK2A1
Hydrochloric Acid SCHEMBL10929080 0.71 ALOX5 (0.35) ALOX5SYKOPRM1OPRK1
SCHEMBL20509484 0.69 CYP1A2 (0.41) ALOX5SYK
SCHEMBL29985513 0.69 CYP1A2 (0.41) ALOX5SYK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0422079-A4 TRICYCLIC LIPOXYGENASE INHIBITING COMPOUNDS, COMPOSITIONS, METHODS OF USE 1991-08-21 EP disclosed
EP-0422079-A1 TRICYCLIC LIPOXYGENASE INHIBITING COMPOUNDS, COMPOSITIONS, METHODS OF USE ABBOTT LABORATORIES (US) 1991-04-17 EP disclosed
WO-1989012636-A1 TRICYCLIC LIPOXYGENASE INHIBITING COMPOUNDS, COMPOSITIONS, METHODS OF USE ABBOTT LABORATORIES (US) 1989-12-28 WO disclosed
EP-0346939-A1 Tricyclic lipoxygenase inhibiting compounds ABBOTT LABORATORIES (US) 1989-12-20 EP disclosed
US-4822811-A Carbazole lipoxygenase inhibiting compounds, compositions and use ABBOTT LABORATORIES (US) 1989-04-18 US disclosed