SCHEMBL7025708

SCHEMBL7025708

O=Cc1coc2ccc(Cl)cc2c1=O.O=Cc1coc2ccccc2c1=O

nearest known ligand 0.86

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 12/20 0.86
▸ MAOB P27338 5/20 0.74
▸ MAOA P21397 4/20 0.74
▸ PTPN2 P17706 2/20 0.62
▸ ALDH1A1 P00352 1/20 0.54
▸ POLB P06746 1/20 0.52

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
SCHEMBL5363245 0.93 PTPN1 (1.00) PTPN1MAOBMAOAPTPN2ALDH1A1
SCHEMBL29952282 0.86 PTPN1 (1.00) PTPN1MAOBMAOAPTPN2ALDH1A1
SCHEMBL127924 0.86 PTPN1 (1.00) PTPN1MAOBMAOAPTPN2ALDH1A1
SCHEMBL29958044 0.83 PTPN1 (0.77) PTPN1MAOBMAOAPTPN2ALDH1A1
SCHEMBL15898959 0.81 PTPN1 (0.78) PTPN1MAOBMAOAPTPN2ALDH1A1
SCHEMBL29954035 0.77 PTPN1 (1.00) PTPN1MAOBMAOAPTPN2ALDH1A1
SCHEMBL4696452 0.75 AHR (0.61) MAOAALDH1A1POLB
SCHEMBL28874629 0.75 MAOB (0.71) PTPN1MAOBMAOAALDH1A1
SCHEMBL11594586 0.75 MAOA (0.67) MAOAALDH1A1POLB
SCHEMBL218740 0.75 MAOA (0.67) MAOAALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2002028366-A9 DEVICES AND METHODS FOR MANAGEMENT OF INFLAMMATION DURECT CORP (US) 2003-02-13 — — WO disclosed
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