SCHEMBL8800540

SCHEMBL8800540

BrCc1cc(Br)cc2ccoc12.OCc1cc(Br)cc2ccoc12

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 2/20 0.33
▸ XDH P47989 1/20 0.31
▸ SLC22A12 Q96S37 1/20 0.31
▸ MAOA P21397 1/20 0.30
▸ ESR1 P03372 1/20 0.30
▸ ESR2 Q92731 1/20 0.30

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
SCHEMBL31305973 0.93 MAOB (0.36) MAOBXDHSLC22A12MAOAESR2
SCHEMBL7482318 0.93 MAOB (0.36) MAOBXDHSLC22A12MAOAESR2
SCHEMBL2104378 0.92 HTR2A (0.32) MAOBESR1ESR2
SCHEMBL3372189 0.71 MAOB (0.46) MAOBXDHSLC22A12MAOA
SCHEMBL23218980 0.70 PTPN1 (0.31) MAOB
SCHEMBL29592780 0.70 PTPN1 (0.31) MAOB
SCHEMBL16426152 0.69 GPR35 (0.37) MAOBMAOA
SCHEMBL21438364 0.69 MEN1 (0.34) MAOA
SCHEMBL21438585 0.69 — —
SCHEMBL7480987 0.68 PKM (0.51) XDHSLC22A12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0783499-A1 BENZOFURAN DERIVATIVES AS TACHYKININ ANTAGONISTS GLAXO GROUP LIMITED (GB) 1997-07-16 — — EP disclosed
WO-1995006645-A1 BENZOFURAN DERIVATIVES AS TACHYKININ ANTAGONISTS GLAXO GROUP LIMITED (GB) 1995-03-09 — — WO disclosed
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