SCHEMBL6204253

SCHEMBL6204253

[O]C(CCO)Cc1ccccc1F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.40
PPARA Q07869 1/20 0.40
TAAR1 Q96RJ0 1/20 0.39
DPP4 P27487 3/20 0.39
LMNA P02545 2/20 0.38
ALDH1A1 P00352 3/20 0.38
RIPK1 Q13546 1/20 0.37
IDO1 P14902 2/20 0.37
HPGD P15428 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
SLC6A3 Q01959 1/20 0.36
KCNH2 Q12809 1/20 0.36
DPP7 Q9UHL4 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
RAB9A P51151 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
SCHEMBL6201831 0.79 DPP4 (0.35) TAAR1DPP4LMNAALDH1A1HPGD
SCHEMBL6204256 0.79 TAAR1 (0.41) PPARGPPARATAAR1DPP4LMNA
SCHEMBL28005766 0.78 TRPA1 (0.44) PPARGPPARATAAR1DPP4ALDH1A1
SCHEMBL6204278 0.78 PPARG (0.40) PPARGPPARATAAR1DPP4ALDH1A1
SCHEMBL6200983 0.74 TAAR1 (0.46) PPARGPPARATAAR1LMNAALDH1A1
SCHEMBL28755681 0.71 IDO1 (0.40) PPARGPPARATAAR1DPP4LMNA
SCHEMBL18901781 0.71 TAAR1 (0.48) PPARGPPARATAAR1LMNAALDH1A1
SCHEMBL28558103 0.71 TAAR1 (0.43) PPARGPPARATAAR1LMNAALDH1A1
SCHEMBL15067498 0.71 TAAR1 (0.43) PPARGPPARATAAR1LMNAALDH1A1
SCHEMBL6201896 0.70 IDO1 (0.38) PPARGPPARATAAR1LMNAALDH1A1

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