SCHEMBL9080926

SCHEMBL9080926

NC(=O)N(O)C1C=C(c2cccc(Sc3ccc(F)cc3)c2)CC1

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.36
MGLL Q99685 2/20 0.34
KDM4C Q9H3R0 2/20 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
SCHEMBL9081519 0.87 ALOX5 (0.38) ALOX5MGLL
SCHEMBL9230200 0.78 MGLL (0.35) MGLLKDM4C
SCHEMBL607599 0.76 SLC9A1 (0.30)
SCHEMBL8707063 0.72 ALOX5 (0.44) ALOX5
SCHEMBL8778130 0.71 ALOX5 (0.65) ALOX5MGLL
SCHEMBL8778127 0.71 ALOX5 (0.65) ALOX5MGLL
SCHEMBL9226766 0.71 MGLL (0.34) MGLL
Hydroxyurea SCHEMBL8712235 0.69 ALOX5 (0.41) ALOX5
SCHEMBL8706620 0.69 ALOX5 (0.43) ALOX5
SCHEMBL9081715 0.68 L3MBTL1 (0.39) MGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0736006-A1 PHENYLTHIOPHENYL CYCLOALKENYL HYDROXYUREAS AS LIPOXYGENASE INHIBITORS PFIZER INC. (US) 1996-10-09 EP claimed
WO-1995017379-A1 PHENYLTHIOPHENYL CYCLOALKENYL HYDROXYUREAS AS LIPOXYGENASE INHIBITORS PFIZER INC. (US) 1995-06-29 WO claimed
EP-0736006-A1 PHENYLTHIOPHENYL CYCLOALKENYL HYDROXYUREAS AS LIPOXYGENASE INHIBITORS PFIZER INC. (US) 1996-10-09 EP disclosed
WO-1995017379-A1 PHENYLTHIOPHENYL CYCLOALKENYL HYDROXYUREAS AS LIPOXYGENASE INHIBITORS PFIZER INC. (US) 1995-06-29 WO disclosed