SCHEMBL4641109

SCHEMBL4641109

Oc1cccc2c1oc1cccc(O)c12

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 8/20 0.72
EGFR P00533 1/20 0.72
KDM5A P29375 1/20 0.55
ATP1A1 P05023 2/20 0.53
ATP1B1 P05026 2/20 0.53
ATP1A3 P13637 2/20 0.53
ATP1B2 P14415 2/20 0.53
ATP1A2 P50993 2/20 0.53
ATP1B3 P54709 2/20 0.53
FXYD2 P54710 2/20 0.53
ATP1A4 Q13733 2/20 0.53
MAPT P10636 2/20 0.48
HPGD P15428 2/20 0.48
RECQL P46063 2/20 0.48
HSD17B10 Q99714 2/20 0.48
APP P05067 1/20 0.48
THRB P10828 1/20 0.48
ALOX15 P16050 1/20 0.48
TSHR P16473 1/20 0.48
CASP1 P29466 1/20 0.48

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
SCHEMBL20754190 0.84 MAOA (0.59) MAOAEGFRKDM5AATP1A1ATP1B1
SCHEMBL30738503 0.84 MAOA (1.00) MAOAEGFRKDM5AATP1A1ATP1B1
SCHEMBL19770521 0.84 MAOA (0.54) MAOAEGFRKDM5AATP1A1ATP1B1
SCHEMBL24343638 0.84 MAOA (0.59) MAOAEGFRKDM5AATP1A1ATP1B1
SCHEMBL15527312 0.84 MAOA (1.00) MAOAEGFRKDM5AATP1A1ATP1B1
SCHEMBL25056598 0.84 MAOA (0.54) MAOAEGFRKDM5AATP1A1ATP1B1
SCHEMBL21331549 0.84 AHR (0.59) MAOAEGFRKDM5AATP1A1ATP1B1
SCHEMBL1301738 0.83 MAOA (0.72) MAOAEGFRKDM5AATP1A1ATP1B1
SCHEMBL22541881 0.81 MAOA (0.51) MAOAEGFRKDM5AMAPTHPGD
SCHEMBL30241374 0.80 MAOA (0.71) MAOAEGFRKDM5AMAPTHPGD

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-1885709-A2 BENZOFURAN DERIVATIVES WITH THERAPEUTIC ACTIVITIES Pharmos Corporation (US) 2008-02-13 EP claimed
WO-2006129318-A2 BENZOFURAN DERIVATIVES WITH THERAPEUTIC ACTIVITIES PHARMOS CORPORATION (US) 2006-12-07 WO claimed