SCHEMBL3815438

SCHEMBL3815438

CN1c2cccc(C(F)(F)F)c2CCN1C(=O)c1cc2ccc(Cl)cn2n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.43
P2RX7 Q99572 8/20 0.36
TP53 P04637 1/20 0.36
PROKR1 Q8TCW9 3/20 0.35
RBP4 P02753 1/20 0.35
AKT1 P31749 2/20 0.35
HSD17B10 Q99714 2/20 0.35
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
KMT2A Q03164 1/20 0.35
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
FAAH O00519 1/20 0.33
PIK3CD O00329 1/20 0.33
CYP3A4 P08684 1/20 0.33
PIK3CA P42336 1/20 0.33
PIK3CB P42338 1/20 0.33

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
SCHEMBL3810581 0.89 NOTUM (0.43) NOTUMP2RX7TP53RBP4AKT1
SCHEMBL3821315 0.88 NOTUM (0.40) NOTUMTP53AKT1LMNATSHR
SCHEMBL3815748 0.88 NOTUM (0.41) NOTUMP2RX7TP53AKT1HSD17B10
SCHEMBL3815573 0.87 NOTUM (0.39) NOTUMTP53PROKR1AKT1LMNA
SCHEMBL3811200 0.87 GRM5 (0.35) NOTUMTP53AKT1HSD17B10LMNA
SCHEMBL929155 0.86 GRM5 (0.44) NOTUMP2RX7RBP4MEN1KMT2A
SCHEMBL3813655 0.85 TP53 (0.36) P2RX7TP53PROKR1RBP4HSD17B10
SCHEMBL3819674 0.84 NOTUM (0.42) NOTUMAKT1MEN1KMT2AALDH1A1
SCHEMBL3811930 0.84 PDCD1 (0.38) AKT1PIK3CDCYP3A4PIK3CAPIK3CB
SCHEMBL3812606 0.83 CCKBR (0.31) TP53LMNATSHRMAPK1ALDH1A1

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
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