SCHEMBL3810312

SCHEMBL3810312

CC1c2nnc(-c3ccc(F)nc3)n2CCN1C(=O)c1cc2ccc(Cl)cn2n1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TACR3 P29371 19/20 0.51
TACR2 P21452 10/20 0.44
TACR1 P25103 8/20 0.44
P2RX7 Q99572 1/20 0.44
KCNH2 Q12809 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43

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
SCHEMBL3819515 0.90 TACR3 (0.51) TACR3TACR2TACR1P2RX7KCNH2
SCHEMBL931448 0.88 TACR3 (0.51) TACR3TACR2TACR1P2RX7KCNH2
SCHEMBL3818998 0.88 TACR3 (0.40) TACR3TACR2TACR1P2RX7KCNH2
SCHEMBL3813684 0.86 TACR3 (0.46) TACR3TACR2TACR1P2RX7KCNH2
SCHEMBL3815133 0.86 TACR3 (0.48) TACR3TACR2TACR1P2RX7KCNH2
SCHEMBL3815625 0.85 TACR3 (0.44) TACR3TACR2TACR1P2RX7KCNH2
SCHEMBL3814901 0.85 TACR3 (0.38) TACR3TACR2TACR1KCNH2CYP1A2
SCHEMBL3812475 0.84 TACR3 (0.46) TACR3TACR2TACR1P2RX7KCNH2
SCHEMBL3812057 0.83 TACR3 (0.45) TACR3TACR2TACR1P2RX7KCNH2
SCHEMBL3814056 0.83 TACR3 (0.46) TACR3TACR2TACR1KCNH2CYP1A2

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