SCHEMBL6205489

SCHEMBL6205489

COC([O])Cc1ccccc1Br

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.44
PPARG P37231 1/20 0.42
PPARA Q07869 1/20 0.42
TAAR1 Q96RJ0 3/20 0.41
TSHR P16473 2/20 0.38
ALDH1A1 P00352 2/20 0.38
NPC1 O15118 1/20 0.38
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CTSS P25774 1/20 0.37
CTSK P43235 1/20 0.37
SLC6A2 P23975 1/20 0.37
SLC6A4 P31645 1/20 0.37
CA12 O43570 1/20 0.37
CA9 Q16790 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
PYCR1 P32322 1/20 0.36

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
SCHEMBL2478903 0.82 IDO1 (0.45) IDO1PPARGPPARATAAR1TSHR
SCHEMBL6205184 0.80 LMNA (0.43) IDO1PPARGPPARATAAR1ALDH1A1
SCHEMBL6205165 0.78 PPARG (0.43) IDO1PPARGPPARATAAR1ALDH1A1
SCHEMBL6206375 0.78 IDO1 (0.48) IDO1TAAR1ALDH1A1MAPTHTT
SCHEMBL6201417 0.78 IDO1 (0.42) IDO1PPARGPPARATAAR1ALDH1A1
SCHEMBL6205490 0.78 IDO1 (0.42) IDO1PPARGPPARATAAR1TSHR
SCHEMBL7666087 0.77 TAAR1 (0.45) IDO1PPARGPPARATAAR1TSHR
SCHEMBL9419162 0.76 IDO1 (0.40) IDO1PPARGPPARATAAR1TSHR
SCHEMBL6203600 0.74 IDO1 (0.47) IDO1PPARGPPARAALDH1A1HTT
SCHEMBL8846321 0.74 POLB (0.45) PPARGPPARATAAR1TSHRALDH1A1

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