SCHEMBL1427993

SCHEMBL1427993

[c]1cncn1-c1ccccn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 2/20 0.39
HTT P42858 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
PLD1 Q13393 1/20 0.38
EP300 Q09472 1/20 0.37
KAT2B Q92831 1/20 0.37
RAB9A P51151 1/20 0.36
GRIN2D O15399 1/20 0.35
GRIN3B O60391 1/20 0.35
GRIN1 Q05586 1/20 0.35
GRIN2A Q12879 1/20 0.35
GRIN2B Q13224 1/20 0.35
GRIN2C Q14957 1/20 0.35
GRIN3A Q8TCU5 1/20 0.35
KDM4E B2RXH2 4/20 0.34
GAA P10253 2/20 0.34
MAPK1 P28482 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
SCHEMBL4800641 0.71 CYP3A4 (0.39) HTTKDM4EGAATSHR
SCHEMBL5582659 0.71 SMN1; SMN2 (0.40) POLBSMN1; SMN2ALDH1A1HTTHSD17B10
SCHEMBL8627801 0.69 POLB (0.41) POLBSMN1; SMN2ALDH1A1HTTHSD17B10
SCHEMBL1558723 0.67 SMN1; SMN2 (0.40) POLBSMN1; SMN2ALDH1A1HTTHSD17B10
SCHEMBL11117869 0.64 POLB (0.47) POLBSMN1; SMN2ALDH1A1HTTHSD17B10
SCHEMBL117382 0.64 CYP3A4 (0.55) ALDH1A1HSD17B10TDP1KDM4EMAPK1
SCHEMBL29401947 0.64 CYP3A4 (0.55) ALDH1A1HSD17B10TDP1KDM4EMAPK1
SCHEMBL1461902 0.63 SMN1; SMN2 (0.48) POLBSMN1; SMN2ALDH1A1HTTHSD17B10
SCHEMBL2816131 0.63 CYP2A6 (0.47) POLBSMN1; SMN2ALDH1A1HTTHSD17B10
Hydrochloric Acid SCHEMBL6446846 0.63 CYP3A4 (0.53) ALDH1A1HSD17B10TDP1KDM4EMAPK1

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-2300466-A1 IMIDAZOPYRIDINE AND IMIDAZOPYRAZINE COMPOUNDS USEFUL AS KINASE INHIBITORS Bristol-Myers Squibb Company (US) 2011-03-30 EP disclosed
WO-2009155388-A1 IMIDAZOPYRIDINE AND IMIDAZOPYRAZINE COMPOUNDS USEFUL AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2009-12-23 WO disclosed