SCHEMBL8965414

SCHEMBL8965414

O=C(O)c1ccc(C=NOC(CC2CCCC2)c2ccc(OCc3cscn3)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 17/20 0.52
PTGS2 P35354 1/20 0.34
RXRA P19793 1/20 0.34
RXRB P28702 1/20 0.34
RGS12 O14924 1/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL8965350 0.99 ALOX5 (0.53) ALOX5
SCHEMBL8965247 0.82 ALOX5 (0.77) ALOX5
SCHEMBL8801742 0.81 ALOX5 (0.53) ALOX5
SCHEMBL8965411 0.77 ALOX5 (0.47) ALOX5
SCHEMBL8965347 0.77 ALOX5 (0.48) ALOX5
SCHEMBL16621263 0.74 NR4A2 (0.53) ALOX5RXRARXRB
SCHEMBL8799902 0.72 ALOX5 (0.53) ALOX5
SCHEMBL8965419 0.72 ALOX5 (0.48) ALOX5RXRARXRB
SCHEMBL8799338 0.71 ALOX5 (0.52) ALOX5
SCHEMBL8965356 0.71 ALOX5 (0.49) ALOX5RXRARXRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5512581-A ANTIINFLAMMATORY AGENT ABBOTT LABORATORIES (US) 1996-04-30 US disclosed