SCHEMBL9836078

SCHEMBL9836078

O=c1c2ccccc2oc2cc(O)c(Cl)c(Cl)c12

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.63
GAA P10253 1/20 0.63
SI P14410 1/20 0.63
MGAM2 Q2M2H8 1/20 0.63
MAOA P21397 10/20 0.62
KDM5A P29375 1/20 0.54
KDM4E B2RXH2 1/20 0.52
ALDH1A1 P00352 1/20 0.52
GLA P06280 1/20 0.52
CYP3A4 P08684 1/20 0.52
MAPT P10636 1/20 0.52
HPGD P15428 1/20 0.52
PGAM1 P18669 1/20 0.52
CASP1 P29466 1/20 0.52
CASP7 P55210 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
HSD17B10 Q99714 1/20 0.52
CA12 O43570 1/20 0.51
CA1 P00915 1/20 0.51
CA9 Q16790 1/20 0.51

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
SCHEMBL28246374 0.89 MAOA (0.69) MGAMGAASIMGAM2MAOA
SCHEMBL9835026 0.87 MAOA (0.70) MGAMGAASIMGAM2MAOA
SCHEMBL7365848 0.81 MAOA (0.75) MGAMGAASIMGAM2MAOA
SCHEMBL9835098 0.79 MGAM (0.74) MGAMGAASIMGAM2MAOA
SCHEMBL31193506 0.79 MGAM (0.74) MGAMGAASIMGAM2MAOA
SCHEMBL30346407 0.78 MGAM (1.00) MGAMGAASIMGAM2MAOA
SCHEMBL2314333 0.78 MGAM (1.00) MGAMGAASIMGAM2MAOA
SCHEMBL28251596 0.77 MAOA (0.69) MGAMGAASIMGAM2MAOA
SCHEMBL11572006 0.77 MAOA (0.59) MGAMGAASIMGAM2MAOA
SCHEMBL873750 0.76 MAOA (1.00) MGAMGAASIMGAM2MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0175376-B1 XANTHONE DERIVATIVES AND PROCESS FOR PRODUCING THE SAME Chugai Seiyaku Kabushiki Kaisha (JP) 1991-04-03 EP disclosed
US-4816479-A HYPOTENSIVE AGENTS, DIURETICS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 1989-03-28 US disclosed
US-4661607-A ANTIEDEMIC AGENTS, HYPOTENSIVE AGENTS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 1987-04-28 US disclosed
EP-0175376-A2 Xanthone derivatives and process for producing the same Chugai Seiyaku Kabushiki Kaisha (JP) 1986-03-26 EP disclosed