SCHEMBL3814901

SCHEMBL3814901

CC1c2nc(-c3ccc(F)nc3)cn2CCN1C(=O)c1cc2ccc(Cl)cn2n1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TACR3 P29371 11/20 0.38
GRM5 P41594 6/20 0.32
TACR2 P21452 4/20 0.32
TACR1 P25103 4/20 0.32
MCHR1 Q99705 1/20 0.32
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HSD17B10 Q99714 1/20 0.31
KCNH2 Q12809 2/20 0.31
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 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
SCHEMBL3821209 0.90 TACR3 (0.38) TACR3GRM5MCHR1ALDH1A1HPGD
SCHEMBL929503 0.88 GRM5 (0.42) TACR3GRM5MCHR1ALDH1A1HPGD
SCHEMBL3818998 0.85 TACR3 (0.40) TACR3TACR2TACR1KCNH2CYP1A2
SCHEMBL3810312 0.85 TACR3 (0.51) TACR3TACR2TACR1KCNH2CYP1A2
SCHEMBL3822949 0.83 P2RX7 (0.33) TACR3GRM5TACR2TACR1ALDH1A1
SCHEMBL3819356 0.82 TACR3 (0.37) TACR3GRM5TACR2TACR1ALDH1A1
SCHEMBL929385 0.81 ESR2 (0.47) GRM5ALDH1A1HPGDHSD17B10
SCHEMBL3816782 0.81 KLKB1 (0.39)
SCHEMBL3812450 0.80 QRFPR (0.37) TACR3GRM5MCHR1
SCHEMBL3820174 0.80 P2RX7 (0.42) GRM5ALDH1A1HPGDSMN1; SMN2HSD17B10

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