SCHEMBL8032011

SCHEMBL8032011

COc1ccc(-c2ccc3c(c2)C(C)N(C)CC3)cn1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 3/20 0.49
HSD17B1 P14061 1/20 0.42
HSD17B2 P37059 1/20 0.42
PDGFRB P09619 1/20 0.41
PDGFRA P16234 1/20 0.41
WDR5 P61964 1/20 0.40
SCD O00767 1/20 0.40
OTUD7B Q6GQQ9 1/20 0.39
USP30 Q70CQ3 1/20 0.39
PIK3CA P42336 3/20 0.39
MTOR P42345 2/20 0.39
ATM Q13315 2/20 0.39
ATR Q13535 2/20 0.39
CYP2A6 P11509 1/20 0.39
KDR P35968 1/20 0.39
RIOK2 Q9BVS4 1/20 0.39
GPR84 Q9NQS5 1/20 0.38
GSK3B P49841 1/20 0.38
PIK3CD O00329 1/20 0.38
PIP5K1C O60331 1/20 0.38

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
SCHEMBL8023234 0.78 MAOA (0.48) MAOAWDR5
SCHEMBL8023501 0.77 CYP11B2 (0.50) MAOA
SCHEMBL1009908 0.76 MAOA (0.49) MAOAHSD17B1HSD17B2CYP2A6
SCHEMBL8025234 0.76 MAOA (0.49) MAOA
SCHEMBL8024479 0.76 BRD4 (0.43) HSD17B1HSD17B2CYP2A6CD274
SCHEMBL6406566 0.75 MTNR1B (0.48) MAOAWDR5USP30PIK3CARIOK2
SCHEMBL8034431 0.75 QPCT (0.46) MAOAMTORATM
SCHEMBL8030414 0.75 MAOA (0.46) MAOAUSP30GPR84GSK3B
SCHEMBL8027382 0.74 MAOA (0.60) MAOA
SCHEMBL8028587 0.72 MAOA (0.45) MAOA

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