SCHEMBL23048269

SCHEMBL23048269

N#CBc1cccc(OCc2ccccc2)c1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CYP4F2 P78329 1/20 0.54
▸ CYP4A11 Q02928 1/20 0.54
▸ MAOB P27338 7/20 0.53
▸ NR4A2 P43354 1/20 0.53
▸ BCHE P06276 3/20 0.50
▸ SGMS2 Q8NHU3 1/20 0.49
▸ MAOA P21397 1/20 0.49
▸ SMPD1 P17405 1/20 0.48
▸ ALOX5 P09917 1/20 0.47
▸ SRD5A2 P31213 1/20 0.47
▸ LCK P06239 1/20 0.47
▸ GUSB P08236 1/20 0.46
▸ PTPN1 P18031 1/20 0.46

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
SCHEMBL14528932 0.79 CYP4F2 (0.63) CYP4F2CYP4A11MAOBNR4A2BCHE
SCHEMBL13626610 0.79 MAOB (0.62) CYP4F2CYP4A11MAOBNR4A2BCHE
SCHEMBL22883006 0.78 CYP4F2 (0.57) CYP4F2CYP4A11MAOBNR4A2BCHE
SCHEMBL1268719 0.77 MAOB (0.81) CYP4F2CYP4A11MAOBNR4A2BCHE
SCHEMBL30344886 0.76 MAOB (0.69) CYP4F2CYP4A11MAOBNR4A2BCHE
SCHEMBL1636426 0.76 BCHE (0.58) CYP4F2CYP4A11MAOBNR4A2BCHE
SCHEMBL538272 0.76 MAOB (0.69) CYP4F2CYP4A11MAOBNR4A2BCHE
SCHEMBL15761340 0.74 BCHE (0.70) CYP4F2CYP4A11MAOBNR4A2BCHE
Benzylphenylether SCHEMBL27762453 0.74 MAOB (0.71) CYP4F2CYP4A11MAOBNR4A2BCHE
SCHEMBL8042202 0.73 MAOB (0.58) CYP4F2CYP4A11MAOBNR4A2BCHE

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-3786156-A1 10H-PHENOTHIAZINE FERROPTOSIS INHIBITOR AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Chengdu Henghao Investment Co. Limited (CN) 2021-03-03 — — EP disclosed
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