SCHEMBL8031040

SCHEMBL8031040

Cc1ccc(-c2ccc3c(c2)CCN(C)C3C)o1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 3/20 0.46
GPR84 Q9NQS5 1/20 0.38
CHRM2 P08172 4/20 0.35
CHRM4 P08173 4/20 0.35
CHRM5 P08912 4/20 0.35
CHRM1 P11229 4/20 0.35
CHRM3 P20309 4/20 0.35
HTR1A P08908 1/20 0.34
KDM4E B2RXH2 3/20 0.33
ALDH1A1 P00352 3/20 0.33
GSK3B P49841 3/20 0.33
GLA P06280 2/20 0.33
HPGD P15428 2/20 0.33
CASP1 P29466 2/20 0.33
CASP7 P55210 2/20 0.33
HSD17B10 Q99714 2/20 0.33
CYP2D6 P10635 1/20 0.33
DRD2 P14416 1/20 0.33
DRD1 P21728 1/20 0.33
GAA P10253 1/20 0.33

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
SCHEMBL8015277 0.89 MAOA (0.46) MAOAGPR84CHRM2CHRM4CHRM5
SCHEMBL8031039 0.78 MAOA (0.49) MAOAKDM4EALDH1A1HSD17B10CYP2D6
SCHEMBL1487592 0.75 MAOA (0.45) MAOACHRM2CHRM4CHRM5CHRM1
SCHEMBL8023049 0.74 MAOA (0.47) MAOAHTR1AKDM4EALDH1A1GLA
SCHEMBL8028105 0.73 MAOA (0.49) MAOADRD2DRD1KDM4C
SCHEMBL8025942 0.73 HTR1A (0.46) HTR1ADRD2DRD1
SCHEMBL8027646 0.73 BRD4 (0.38) MAOACHRM2CHRM4CHRM5CHRM1
SCHEMBL8012553 0.73 BRD4 (0.48) MAOAALDH1A1DRD2
SCHEMBL8027330 0.72 MAOA (0.48) MAOADRD2KDM4C
SCHEMBL8024459 0.71 MAOA (0.47) MAOAKDM4EALDH1A1DRD2

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-2009095253-A1 6-HALO-PYRAZOLO[1, 5-A]PYRIDINES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR (MGLUR) MODULATORS MERZ PHARMA GMBH & CO. KGAA (DE) 2009-08-06 WO disclosed