SCHEMBL6205189

SCHEMBL6205189

[O]C(OCc1ccccc1)c1cccc(F)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.48
SLC6A9 P48067 1/20 0.46
SLC6A5 Q9Y345 1/20 0.46
IDO1 P14902 3/20 0.45
TDO2 P48775 1/20 0.45
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
PPARG P37231 1/20 0.42
PPARA Q07869 1/20 0.42
AGXT P21549 2/20 0.42
HCAR2 Q8TDS4 1/20 0.39
NR4A2 P43354 1/20 0.39
TACR1 P25103 1/20 0.39
FFAR1 O14842 1/20 0.39
OPRM1 P35372 1/20 0.39
OPRL1 P41146 1/20 0.39
MAOB P27338 1/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39

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
SCHEMBL790660 0.82 SLC6A2 (0.47) IDO1MEN1KMT2AAGXTTACR1
SCHEMBL4599464 0.81 IDO1 (0.45) CNR2SLC6A9SLC6A5IDO1TDO2
SCHEMBL6205190 0.81 CNR2 (0.48) CNR2SLC6A9SLC6A5IDO1TDO2
SCHEMBL6035746 0.78 IDO1 (0.43) CNR2SLC6A9SLC6A5IDO1TDO2
SCHEMBL28752767 0.73 HDAC4 (0.41) CNR2SLC6A9SLC6A5IDO1TDO2
SCHEMBL8658086 0.73 KMT2A (0.51) MEN1KMT2APPARGNR4A2MAOB
SCHEMBL27648354 0.73 CNR2 (0.50) CNR2SLC6A9SLC6A5MEN1KMT2A
SCHEMBL2650837 0.72 IDO1 (0.51) IDO1TDO2AGXTHCAR2NR4A2
SCHEMBL2651551 0.72 MRGPRX4 (0.54)
SCHEMBL22785928 0.72 CA1 (0.47) CNR2SLC6A9SLC6A5IDO1TDO2

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