SCHEMBL8804333

SCHEMBL8804333

CCc1nc2c(-c3ccccc3)cc(C)nc2[nH]1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 7/20 0.49
ADORA2A P29274 6/20 0.49
ADORA3 P0DMS8 4/20 0.49
SMN1; SMN2 Q16637 1/20 0.46
L3MBTL1 Q9Y468 3/20 0.44
TP53 P04637 1/20 0.44
GAA P10253 2/20 0.42
CRHR1 P34998 1/20 0.39
MAPT P10636 1/20 0.39
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 2/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CCNB2 O95067 1/20 0.38
CDK1 P06493 1/20 0.38
CCNB1 P14635 1/20 0.38
CDK5 Q00535 1/20 0.38
CDK5R1 Q15078 1/20 0.38
CCNB3 Q8WWL7 1/20 0.38
DDAH1 O94760 1/20 0.38

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
SCHEMBL3225015 0.77 ADORA1 (0.41) ADORA1ADORA2ASMN1; SMN2L3MBTL1TP53
SCHEMBL8805263 0.77 SMN1; SMN2 (0.56) ADORA1ADORA2AADORA3SMN1; SMN2L3MBTL1
SCHEMBL1918476 0.76 ADORA1 (0.54) ADORA1ADORA2AADORA3SMN1; SMN2L3MBTL1
SCHEMBL4368747 0.73 HTT (0.45) ADORA1ADORA2AADORA3SMN1; SMN2L3MBTL1
SCHEMBL23105399 0.71 DDAH1 (0.53) ADORA1ADORA2AADORA3SMN1; SMN2L3MBTL1
SCHEMBL4367112 0.70 ADORA1 (0.41) ADORA1ADORA2AADORA3HPGDHSD17B10
SCHEMBL12532869 0.69 RPS6KA3 (0.48) ADORA1ADORA2AADORA3SMN1; SMN2L3MBTL1
SCHEMBL3218809 0.69 POLB (0.41) SMN1; SMN2L3MBTL1TP53GAADDAH1
SCHEMBL1696508 0.66 TP53 (0.53) ADORA1ADORA2AADORA3SMN1; SMN2L3MBTL1
SCHEMBL19116734 0.66 L3MBTL1 (0.61) ADORA1ADORA2AADORA3SMN1; SMN2L3MBTL1

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-0645389-B1 Process for the production of imidazopyridines LONZA AG (CH) 1997-02-05 EP disclosed
US-5446160-A Process for preparing imidazopyridine derivatives LONZA LTD. (CH) 1995-08-29 US disclosed
EP-0645389-A1 Process for the production of imidazopyridines LONZA A.G. (CH) 1995-03-29 EP disclosed