SCHEMBL6181935

SCHEMBL6181935

FC(F)(F)c1ccc(COc2cccc(OCCCl)c2)cc1

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAOB P27338 12/20 0.58
MAOA P21397 5/20 0.55
PTPN2 P17706 1/20 0.55
PTPN1 P18031 1/20 0.55
PTPRB P23467 1/20 0.55
PTPN6 P29350 1/20 0.55
PTPN11 Q06124 1/20 0.55
F10 P00742 1/20 0.47
MRGPRX4 Q96LA9 1/20 0.46

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
SCHEMBL5512565 0.84 MAOB (0.59) MAOBMAOAPTPN2PTPN1PTPRB
SCHEMBL10335673 0.83 MAOB (0.65) MAOBMAOAPTPN2PTPN1PTPRB
SCHEMBL791923 0.82 MAOB (0.69) MAOBMAOAPTPN2PTPN1PTPRB
SCHEMBL6573378 0.81 L3MBTL1 (0.59) MAOBMRGPRX4
SCHEMBL18797717 0.79 MAOB (0.60) MAOBMAOAPTPN2PTPN1PTPRB
SCHEMBL18797716 0.79 MAOB (0.60) MAOBMAOAPTPN2PTPN1PTPRB
SCHEMBL5369936 0.79 MAOB (0.67) MAOBMAOAPTPN2PTPN1PTPRB
SCHEMBL19665980 0.79 MAOB (0.60) MAOBMAOAPTPN2PTPN1PTPRB
SCHEMBL16948434 0.79 MAOB (0.71) MAOBMAOAPTPN2PTPN1PTPRB
SCHEMBL19685525 0.78 MAOB (0.63) MAOBMAOAPTPN2PTPN1PTPRB

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-1494989-A2 COMPOUNDS THAT MODULATE PPAR ACTIVITY AND METHODS FOR THEIR PREPARATION WARNER-LAMBERT COMPANY LLC (US) 2005-01-12 EP disclosed
WO-2003084916-A2 COMPOUNDS THAT MODULATE PPAR ACTIVITY AND METHODS FOR THEIR PREPARATION WARNER-LAMBERT COMPANY LLC (US) 2003-10-16 WO disclosed