SCHEMBL3820174

SCHEMBL3820174

O=C(c1cc2ccc(Cl)cn2n1)N1CCn2cc(-c3ccc(F)nc3)nc2C1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 11/20 0.42
NAMPT P43490 1/20 0.37
ALDH1A1 P00352 3/20 0.36
HSD17B10 Q99714 2/20 0.36
HPGD P15428 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HDAC6 Q9UBN7 1/20 0.35
GRM5 P41594 3/20 0.35
NPC1 O15118 2/20 0.34
HTT P42858 2/20 0.34
RAB9A P51151 2/20 0.34
LMNA P02545 1/20 0.34
KDM4E B2RXH2 1/20 0.34
TSHR P16473 1/20 0.34
ESR1 P03372 1/20 0.34
POLB P06746 1/20 0.34
ESR2 Q92731 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
SCHEMBL3821362 0.89 ALDH1A1 (0.41) P2RX7NAMPTALDH1A1HPGDHDAC6
SCHEMBL928116 0.88 GRM5 (0.47) P2RX7NAMPTALDH1A1HSD17B10HPGD
SCHEMBL3819173 0.84 P2RX7 (0.50) P2RX7
SCHEMBL3820689 0.84 P2RX7 (0.49) P2RX7HDAC6
SCHEMBL3817045 0.82 P2RX7 (0.39) P2RX7NAMPTALDH1A1HSD17B10HDAC6
SCHEMBL930056 0.80 ALDH1A1 (0.56) ALDH1A1HSD17B10HPGDGRM5KDM4E
SCHEMBL3814901 0.80 TACR3 (0.38) ALDH1A1HSD17B10HPGDSMN1; SMN2GRM5
SCHEMBL3815558 0.80 P2RX7 (0.53) P2RX7ALDH1A1HSD17B10HDAC6GRM5
SCHEMBL3810702 0.77 SCD (0.50) P2RX7NAMPTALDH1A1HSD17B10GRM5
SCHEMBL3816866 0.75 NAMPT (0.44) P2RX7NAMPTALDH1A1HSD17B10GRM5

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