SCHEMBL14464475

SCHEMBL14464475

O=C(c1cc2cc(F)ccc2oc1=O)c1cc2cc(Cl)ccc2oc1=O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.67
▸ MAOB P27338 4/20 0.67
▸ GPR35 Q9HC97 2/20 0.67
▸ ALDH1A1 P00352 1/20 0.67
▸ CYP1A2 P05177 1/20 0.67
▸ CYP2C9 P11712 1/20 0.67
▸ L3MBTL1 Q9Y468 1/20 0.67
▸ TSHR P16473 2/20 0.58
▸ HSD17B10 Q99714 1/20 0.56
▸ MEN1 O00255 5/20 0.54
▸ KMT2A Q03164 5/20 0.54
▸ GAA P10253 1/20 0.54
▸ NPC1 O15118 1/20 0.52
▸ RAB9A P51151 1/20 0.52
▸ ATM Q13315 2/20 0.51
▸ MAPT P10636 2/20 0.51
▸ CA12 O43570 1/20 0.50
▸ CA9 Q16790 1/20 0.50
▸ NT5E P21589 1/20 0.49
▸ F12 P00748 1/20 0.47

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
SCHEMBL1369097 0.91 ATM (0.58) KDM4EMAOBGPR35ALDH1A1CYP1A2
SCHEMBL1366856 0.91 KDM4E (0.79) KDM4EMAOBGPR35ALDH1A1CYP1A2
SCHEMBL13857104 0.84 MAOB (0.68) KDM4EMAOBGPR35ALDH1A1CYP1A2
SCHEMBL14464476 0.84 MAOB (0.68) KDM4EMAOBGPR35ALDH1A1CYP1A2
SCHEMBL14464469 0.83 KDM4E (0.67) KDM4EMAOBGPR35ALDH1A1CYP1A2
SCHEMBL13857249 0.83 MAOB (0.69) KDM4EMAOBGPR35ALDH1A1CYP1A2
SCHEMBL1368563 0.82 KDM4E (0.79) KDM4EMAOBGPR35ALDH1A1CYP1A2
SCHEMBL9068782 0.80 KDM4E (1.00) KDM4EMAOBGPR35ALDH1A1CYP1A2
SCHEMBL9068774 0.80 MAOA (0.69) KDM4EMAOBGPR35ALDH1A1CYP1A2
SCHEMBL31315658 0.80 MAOA (0.69) KDM4EMAOBGPR35ALDH1A1CYP1A2

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-2007082178-A2 PROSTAGLANDIN REDUCTASE INHIBITORS ABGENOMICS CORPORATION (TW) 2007-07-19 — — WO disclosed
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