SCHEMBL6203594

SCHEMBL6203594

COC([O])Cc1ccc(F)c(F)c1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
DPP4 P27487 2/20 0.37
ALDH1A1 P00352 2/20 0.36
HTT P42858 2/20 0.36
MAPT P10636 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
DAO P14920 2/20 0.36
RIPK1 Q13546 1/20 0.36
DPP7 Q9UHL4 1/20 0.35
LDHA P00338 1/20 0.34

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
SCHEMBL6205901 0.79 TRPA1 (0.46) MAOAMAOB
SCHEMBL6203597 0.78 MAOA (0.40) MAOAMAOBDPP4ALDH1A1HTT
SCHEMBL6204382 0.76 SLC1A1 (0.46) MAOB
SCHEMBL6204802 0.76 MEN1 (0.40) ALDH1A1HTTMAPTL3MBTL1LDHA
SCHEMBL31694009 0.75 DPP4 (0.44) DPP4DPP7
SCHEMBL6203919 0.74 PNMT (0.55)
SCHEMBL9176216 0.74 GABRA1 (0.48) DPP4ALDH1A1HTTMAPT
SCHEMBL2623873 0.74 GABRA1 (0.48) DPP4ALDH1A1HTTMAPT
SCHEMBL16798238 0.74 PTPRB (0.50) MAOAMAOBDPP4ALDH1A1LDHA
SCHEMBL15178216 0.74 ALDH1A1 (0.37) MAOAMAOBDPP4ALDH1A1HTT

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-1506175-A1 N-SUBSTITUTED TRICYCLIC 3-AMINOPYRAZOLES AS PDGF RECEPTOR INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2005-02-16 EP disclosed
WO-2003097609-A1 N-SUBSTITUTED TRICYCLIC 3-AMINOPYRAZOLES AS PDFG RECEPTOR INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2003-11-27 WO disclosed