SCHEMBL6962919

SCHEMBL6962919

COC(=O)c1cnc2cc(CBr)ccc2c1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.51
HPGDS O60760 12/20 0.48
CYP4F2 P78329 1/20 0.47
CYP4A11 Q02928 1/20 0.47
ALOX15 P16050 1/20 0.46
HTT P42858 1/20 0.46
PSMD14 O00487 1/20 0.45
MAPK1 P28482 1/20 0.42

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
SCHEMBL25308335 0.89 ALOX15 (0.49) MAOBHPGDSCYP4F2CYP4A11ALOX15
SCHEMBL30527598 0.89 ALOX15 (0.49) MAOBHPGDSCYP4F2CYP4A11ALOX15
SCHEMBL6960807 0.81 HPGDS (0.48) MAOBHPGDSALOX15HTTPSMD14
SCHEMBL2001821 0.81 HPGDS (0.51) MAOBHPGDSALOX15HTTPSMD14
SCHEMBL17221411 0.80 MAOB (0.53) MAOBHPGDSALOX15HTTPSMD14
SCHEMBL1043657 0.80 HPGDS (0.52) MAOBHPGDSALOX15HTTPSMD14
SCHEMBL7440151 0.79 PTPN11 (0.53) CYP4F2CYP4A11ALOX15HTT
SCHEMBL30917343 0.79 PTPN11 (0.53) CYP4F2CYP4A11ALOX15HTT
SCHEMBL3575601 0.78 HPGDS (0.54) MAOBHPGDSALOX15HTTPSMD14
SCHEMBL19021550 0.78 HPGDS (0.74) MAOBHPGDS

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-0787725-B1 QUINOLINE DERIVATIVE NIPPON CHEMIPHAR CO (JP) 2003-04-23 EP disclosed
CN-1071333-C Quinoline derivative NIPPON CHEMIPHAR CO (JP) 2001-09-19 CN disclosed
CN-1170411-A Quinoline derivative NIPPON CHEMIPHAR CO (JP) 1998-01-14 CN disclosed
US-5693651-A HYPOGLYCEMIC AGENTS NIPPON CHEMIPHAR CO., LTD. (JP) 1997-12-02 US disclosed
EP-0787725-A1 QUINOLINE DERIVATIVE NIPPON CHEMIPHAR CO., LTD. (JP) 1997-08-06 EP disclosed