SCHEMBL3817040

SCHEMBL3817040

CC1c2ccc3c(c2CCN1C(=O)c1cc2ccc(Cl)cn2n1)C(=O)N(C)C3

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
ITGB2 P05107 1/20 0.32
ICAM1 P05362 1/20 0.32
ITGAL P20701 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
DRD1 P21728 1/20 0.32
PARP1 P09874 1/20 0.31
QRFPR Q96P65 1/20 0.31
PRLHR P49683 2/20 0.31
TRPC3 Q13507 1/20 0.31
TRPC6 Q9Y210 1/20 0.31
MGLL Q99685 2/20 0.30
SPR P35270 3/20 0.30
GRM5 P41594 1/20 0.30

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
SCHEMBL3821039 0.90 GRM5 (0.32) MAPK1PARP1GRM5
SCHEMBL3819163 0.87 MAPK1 (0.33) MAPK1NPSR1MEN1KMT2ADRD1
SCHEMBL1011176 0.86 GRM5 (0.42) MAPK1NPSR1QRFPRGRM5
SCHEMBL3820067 0.81 DRD1 (0.42) MAPK1NPSR1DRD1TRPC3TRPC6
SCHEMBL3816607 0.81 KMT2A (0.42) MAPK1MEN1KMT2ADRD1PARP1
SCHEMBL3815643 0.81 MAPT (0.38) MAPK1NPSR1DRD1TRPC3TRPC6
SCHEMBL3813529 0.81 F11 (0.40) MAPK1NPSR1MEN1KMT2ADRD1
SCHEMBL3819764 0.80 MAPK1 (0.34) MAPK1NPSR1MGLLGRM5
SCHEMBL3816988 0.80 F11 (0.39) MAPK1NPSR1DRD1PARP1GRM5
SCHEMBL1011577 0.79 GRM5 (0.47) KMT2AGRM5

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 3 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
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