SCHEMBL6960868

SCHEMBL6960868

COC(=O)C(Cl)Cc1cnc2cc(OCc3ccccc3)ccc2c1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAOB P27338 12/20 0.52
HPGDS O60760 1/20 0.47
CYP3A4 P08684 1/20 0.47
LTA4H P09960 1/20 0.46
PTPN1 P18031 1/20 0.45
PDGFRB P09619 1/20 0.44
PDGFRA P16234 1/20 0.44
MEN1 O00255 1/20 0.43
HSP90AA1 P07900 1/20 0.43
KMT2A Q03164 1/20 0.43
PPARG P37231 1/20 0.43
PPARD Q03181 1/20 0.43
PPARA Q07869 1/20 0.43

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
SCHEMBL7556849 0.91 MAOB (0.52) MAOBPTPN1
SCHEMBL6965631 0.89 CYP3A4 (0.51) MAOBHPGDSCYP3A4PTPN1PPARG
SCHEMBL27383098 0.83 MAOB (0.52) MAOBHPGDSCYP3A4MEN1HSP90AA1
SCHEMBL6967080 0.81 MAOB (0.58) MAOBCYP3A4MEN1HSP90AA1KMT2A
SCHEMBL4393180 0.80 LTA4H (0.67) MAOBLTA4HPPARGPPARDPPARA
SCHEMBL7556674 0.80 MAOB (0.48) MAOBHPGDSLTA4HPTPN1
SCHEMBL18571363 0.78 CYP3A4 (0.59) MAOBHPGDSCYP3A4PDGFRBPDGFRA
SCHEMBL18571617 0.78 MAOB (0.67) MAOBHPGDSCYP3A4PDGFRBPDGFRA
SCHEMBL18571362 0.76 CYP3A4 (0.61) MAOBCYP3A4PDGFRBPDGFRAHSP90AA1
SCHEMBL5689720 0.75 LTA4H (0.51) MAOBLTA4HMEN1KMT2APPARG

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 3 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
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