SCHEMBL3814892

SCHEMBL3814892

CC1c2c[nH]cc2CCN1C(=O)c1cc2ccc(Cl)cn2n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
DRD1 P21728 1/20 0.36
QRFPR Q96P65 1/20 0.35
GRM5 P41594 2/20 0.34
TRPC3 Q13507 1/20 0.34
TRPC6 Q9Y210 1/20 0.34
SPR P35270 3/20 0.34
PARP1 P09874 1/20 0.34
HTT P42858 2/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
PKM P14618 1/20 0.34
ALOX15 P16050 1/20 0.34
MAPK1 P28482 1/20 0.34
HSD17B10 Q99714 1/20 0.34
RIPK1 Q13546 1/20 0.33
KDM4E B2RXH2 1/20 0.33
NCOA1 Q15788 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL3816607 0.88 KMT2A (0.42) MEN1KMT2ADRD1GRM5TRPC3
SCHEMBL3816872 0.88 HTT (0.37) MEN1KMT2AGRM5HTTGAA
SCHEMBL3812114 0.87 DRD1 (0.49) MEN1KMT2ADRD1GRM5TRPC3
SCHEMBL3824223 0.87 DRD1 (0.49) MEN1KMT2ADRD1GRM5TRPC3
SCHEMBL8012792 0.87 DRD1 (0.49) MEN1KMT2ADRD1GRM5TRPC3
SCHEMBL3811755 0.86 KMT2A (0.43) MEN1KMT2ADRD1QRFPRHTT
SCHEMBL3810668 0.85 KMT2A (0.41) MEN1KMT2ADRD1GRM5HTT
SCHEMBL3820674 0.84 P2RX7 (0.37) MEN1KMT2ADRD1QRFPRGRM5
SCHEMBL3812712 0.84 KMT2A (0.41) MEN1KMT2ADRD1QRFPRHTT
SCHEMBL3816636 0.84 KMT2A (0.41) MEN1KMT2ADRD1GRM5PARP1

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 2 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 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