SCHEMBL3815399

SCHEMBL3815399

CCC1c2cc(F)ccc2CCN1C(=O)c1cc2ccc(Cl)cn2n1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 1/20 0.42
CYP2D6 P10635 2/20 0.36
GRIN2C Q14957 3/20 0.36
TP53 P04637 3/20 0.36
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
PARP1 P09874 1/20 0.36
MTNR1B P49286 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
RXFP1 Q9HBX9 1/20 0.35
KDM4E B2RXH2 1/20 0.34
NPC1 O15118 1/20 0.34
POLB P06746 1/20 0.34
RECQL P46063 1/20 0.34
RAB9A P51151 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
SCHEMBL3810869 0.93 MTNR1B (0.43) OPRK1CYP2D6GRIN2CMTNR1B
SCHEMBL3820983 0.90 TP53 (0.35) OPRK1CYP2D6GRIN2CTP53HTR2A
SCHEMBL3811239 0.87 MEN1 (0.42) OPRK1GRIN2CMTNR1BMEN1KMT2A
SCHEMBL3814958 0.87 PARP1 (0.44) OPRK1CYP2D6HTR2AHTR2CPARP1
SCHEMBL4024373 0.87 PARP1 (0.44) OPRK1CYP2D6HTR2AHTR2CPARP1
SCHEMBL3818286 0.85 OPRK1 (0.36) OPRK1CYP2D6HTR2AHTR2CPARP1
SCHEMBL1009696 0.85 GRM5 (0.44) OPRK1GRIN2CTP53MEN1KMT2A
SCHEMBL3815189 0.84 LMNA (0.36) OPRK1CYP2D6GRIN2CMEN1KMT2A
SCHEMBL3819977 0.83 F11 (0.38) TP53HTR2AHTR2CKDM4ENPC1
SCHEMBL3821156 0.82 DRD1 (0.39) CYP2D6HTR2AHTR2CPARP1MTNR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2090576-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) 2009-08-19 EP claimed
EP-2090576-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) 2009-08-19 EP disclosed
EP-2090576-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) 2009-08-19 EP disclosed
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