SCHEMBL14426263

SCHEMBL14426263

Cc1cc(N2CCC(N(C)C)C2)ccc1N1CCc2cc(O)ccc2C1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FPR1 P21462 2/20 0.39
FPR2 P25090 2/20 0.39
MCHR1 Q99705 7/20 0.36
CYP11B1 P15538 2/20 0.35
CYP11B2 P19099 2/20 0.35
DRD2 P14416 1/20 0.35
DRD4 P21917 1/20 0.35
DRD3 P35462 1/20 0.35
ESR1 P03372 1/20 0.35
ESR2 Q92731 1/20 0.35
PDGFRB P09619 1/20 0.35
FGFR1 P11362 1/20 0.35
KDR P35968 1/20 0.35
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GLA P06280 1/20 0.34
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34
CASP1 P29466 1/20 0.34
RAD52 P43351 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
SCHEMBL4292252 0.88 MCHR1 (0.40) FPR1FPR2MCHR1CYP11B1CYP11B2
SCHEMBL4288189 0.85 WDR5 (0.41) FPR1FPR2MCHR1CYP11B1CYP11B2
SCHEMBL4287520 0.84 FPR1 (0.49) FPR1FPR2CYP11B1CYP11B2DRD2
SCHEMBL4287527 0.84 FPR1 (0.49) FPR1FPR2CYP11B1CYP11B2DRD2
SCHEMBL13659165 0.83 MCHR1 (0.44) MCHR1AOC3KCNH2
SCHEMBL12966613 0.79 AOC3 (0.44) FPR1FPR2MCHR1CYP11B1CYP11B2
SCHEMBL13659199 0.76 FPR1 (0.46) FPR1FPR2AOC3WDR5
SCHEMBL13659205 0.75 FPR1 (0.46) FPR1FPR2MCHR1KDRAOC3
SCHEMBL4290289 0.74 FPR1 (0.47) FPR1FPR2MCHR1PDGFRBFGFR1
SCHEMBL4290282 0.74 FPR1 (0.47) FPR1FPR2MCHR1PDGFRBFGFR1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007093364-A1 AZACYCLYL-SUBSTITUTED ARYLDIHYDROISOQUINOLINONES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS SANOFI-AVENTIS (DE) 2007-08-23 WO disclosed