SCHEMBL8778208

SCHEMBL8778208

NC(=O)N(O)[C@H]1C[C@@H](c2cccc(Oc3ccc(Cl)cc3)c2)C1

nearest known ligand 0.79

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 4/20 0.79
KCNH2 Q12809 1/20 0.40
PARP14 Q460N5 4/20 0.40
PARP10 Q53GL7 4/20 0.40
DRD2 P14416 1/20 0.38
TNKS O95271 1/20 0.38
PARP15 Q460N3 1/20 0.38
TNKS2 Q9H2K2 1/20 0.38
PARP2 Q9UGN5 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
SCHEMBL8778183 1.00 ALOX5 (0.79) ALOX5KCNH2PARP14PARP10DRD2
SCHEMBL8778188 1.00 ALOX5 (0.79) ALOX5KCNH2PARP14PARP10DRD2
SCHEMBL7971116 0.90 ALOX5 (0.82) ALOX5KCNH2PARP14PARP10
SCHEMBL7971112 0.90 ALOX5 (0.82) ALOX5KCNH2PARP14PARP10
SCHEMBL9163994 0.90 ALOX5 (0.82) ALOX5KCNH2PARP14PARP10
SCHEMBL9158468 0.88 ALOX5 (1.00) ALOX5KCNH2PARP14PARP10
SCHEMBL9158475 0.88 ALOX5 (1.00) ALOX5KCNH2PARP14PARP10
SCHEMBL9163312 0.88 ALOX5 (1.00) ALOX5KCNH2PARP14PARP10
SCHEMBL9165813 0.85 ALOX5 (0.74) ALOX5KCNH2PARP14PARP10TNKS
SCHEMBL9165807 0.85 ALOX5 (0.74) ALOX5KCNH2PARP14PARP10TNKS

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
EP-0636119-B1 PHENYL SUBSTITUTED CYCLOALKYL HYDROXYUREA DERIVATIVES WHICH INHIBIT LIPOXYGENASE PFIZER (US) 1997-11-05 EP disclosed