SCHEMBL8024476

SCHEMBL8024476

COc1ncc(-c2cccc3c2CCN(C)C3C)c(OC)n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTOR P42345 2/20 0.36
GABRG2 P18507 1/20 0.36
GABRB3 P28472 1/20 0.36
GABRA2 P47869 1/20 0.36
PPARD Q03181 1/20 0.35
MAOA P21397 2/20 0.34
QPCT Q16769 1/20 0.34
QPCTL Q9NXS2 1/20 0.34
GRM5 P41594 1/20 0.34
GRM1 Q13255 1/20 0.34
HSD11B1 P28845 1/20 0.33
KLKB1 P03952 1/20 0.33
MDM2 Q00987 5/20 0.33
CYP1A2 P05177 1/20 0.32
METAP2 P50579 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL8024478 0.81 BRD9 (0.42) MAOAGRM5GRM1CYP1A2METAP2
SCHEMBL8030192 0.81 SCN9A (0.42) MTORMAOAKLKB1KDM4EALDH1A1
SCHEMBL8032003 0.79 PPARD (0.46) MTORPPARDMAOAQPCTQPCTL
SCHEMBL1011096 0.78 QPCT (0.37) MTORGABRG2GABRB3GABRA2PPARD
SCHEMBL8034431 0.76 QPCT (0.46) MTORPPARDMAOAQPCTQPCTL
SCHEMBL8024479 0.74 BRD4 (0.43) GRM5
SCHEMBL3811163 0.73 KLKB1 (0.41) PPARDKLKB1MDM2MEN1KMT2A
SCHEMBL1010607 0.73 GRM5 (0.46) GRM5ALDH1A1HPGDKMT2A
SCHEMBL1010108 0.73 KLKB1 (0.41) PPARDGRM5KLKB1MDM2MEN1
SCHEMBL8028625 0.71 GRM5 (0.38) MTORMAOAGRM5GRM1

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