SCHEMBL9834901

SCHEMBL9834901

O=C(O)C1Cc2cc3c(=O)c4ccccc4oc3c(Cl)c2O1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TTR P02766 6/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ MAOA P21397 6/20 0.39
▸ ACSL3 O95573 1/20 0.39
▸ ACSL1 P33121 1/20 0.39
▸ ACSL6 Q9UKU0 1/20 0.39
▸ ADORA3 P0DMS8 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ GLA P06280 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ PGAM1 P18669 1/20 0.38
▸ CASP1 P29466 1/20 0.38
▸ CASP7 P55210 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ PTGS2 P35354 1/20 0.38
▸ AHR P35869 1/20 0.37
▸ TBK1 Q9UHD2 1/20 0.37

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
SCHEMBL9834412 0.87 TTR (0.45) TTRSMN1; SMN2MAOAKDM4EALDH1A1
SCHEMBL9837053 0.86 TTR (0.49) TTRSMN1; SMN2MAOAACSL3ACSL1
SCHEMBL9836749 0.85 SMN1; SMN2 (0.36) TTRSMN1; SMN2MAOA
SCHEMBL9835296 0.82 TTR (0.52) TTRSMN1; SMN2MAOAACSL3ACSL1
SCHEMBL9834130 0.77 TTR (0.52) TTRSMN1; SMN2MAOAACSL3ACSL1
SCHEMBL10537230 0.77 TTR (0.44) TTRSMN1; SMN2MAOAACSL3ACSL1
SCHEMBL9834701 0.75 MAOA (0.49) TTRSMN1; SMN2MAOAADORA3KDM4E
SCHEMBL10808391 0.73 SMN1; SMN2 (0.39) SMN1; SMN2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL10801805 0.72 FFAR4 (0.43) SMN1; SMN2
SCHEMBL9837354 0.72 MAOA (0.37) TTRSMN1; SMN2MAOAKDM4ECYP3A4

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-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
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