SCHEMBL6203600

SCHEMBL6203600

COC([O])Cc1ccccc1C(F)(F)F

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.47
PPARG P37231 4/20 0.45
PPARA Q07869 1/20 0.45
MAOB P27338 3/20 0.42
MAOA P21397 1/20 0.42
POLQ O75417 1/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HTT P42858 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
NPSR1 Q6W5P4 1/20 0.39
EPHX2 P34913 3/20 0.39
DPP4 P27487 1/20 0.38
DPP7 Q9UHL4 1/20 0.38

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
SCHEMBL6203603 0.79 IDO1 (0.47) IDO1PPARGPPARAMAOBMAOA
SCHEMBL30184157 0.77 IDO1 (0.47) IDO1PPARGPPARAPOLQKMT2A
SCHEMBL6201417 0.77 IDO1 (0.42) IDO1PPARGPPARAMAOBKMT2A
SCHEMBL320896 0.76 IDO1 (0.50) IDO1PPARGPPARAPOLQSLC6A2
SCHEMBL28019827 0.74 PPARG (0.47) IDO1PPARGPPARAMAOBMAOA
SCHEMBL6205489 0.74 IDO1 (0.44) IDO1PPARGPPARAKMT2AMEN1
SCHEMBL6205184 0.74 LMNA (0.43) IDO1PPARGPPARAMAOBKMT2A
SCHEMBL18305224 0.73 DPP4 (0.47) IDO1PPARGPPARAMAOBMAOA
SCHEMBL3911976 0.73 DPP4 (0.47) IDO1PPARGPPARAMAOBMAOA
SCHEMBL239404 0.73 IDO1 (0.55) IDO1MAOBMAOAPOLQKMT2A

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
CN-1668601-A N-substituted tricyclic 3-aminopyrazoles as PDFG receptor inhibitors JANSSEN PHARMACEUTICA NV (BE) 2005-09-14 CN disclosed
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