SCHEMBL4552599

SCHEMBL4552599

CCC(=O)Nc1cc(NC(=O)CC)nc(NC(=O)CC)c1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.55
KMT2A Q03164 1/20 0.55
ALDH1A1 P00352 1/20 0.51
ADORA3 P0DMS8 14/20 0.51
ADORA1 P30542 9/20 0.51
ADORA2A P29274 8/20 0.51
ADORA2B P29275 5/20 0.51
NR4A1 P22736 1/20 0.49
RAB9A P51151 1/20 0.49
CYP3A4 P08684 1/20 0.49
GAA P10253 1/20 0.47

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
SCHEMBL3090260 0.83 POLB (0.67) POLBKMT2AALDH1A1NR4A1RAB9A
SCHEMBL4428432 0.80 ADORA3 (0.56) ADORA3ADORA1ADORA2AADORA2B
SCHEMBL631091 0.78 JAK2 (0.68) POLBKMT2ANR4A1RAB9ACYP3A4
SCHEMBL4551457 0.78 SMN1; SMN2 (0.65) POLBKMT2AADORA3ADORA1ADORA2A
SCHEMBL4413569 0.78 ADORA3 (0.45) ALDH1A1ADORA3ADORA1ADORA2AADORA2B
SCHEMBL12182431 0.76 MAPK1 (0.65) ALDH1A1ADORA3ADORA1ADORA2AADORA2B
SCHEMBL2716542 0.75 ADORA3 (0.51) POLBALDH1A1ADORA3ADORA1ADORA2A
SCHEMBL12240557 0.75 CYP3A4 (0.59) POLBKMT2AALDH1A1NR4A1RAB9A
SCHEMBL22809613 0.74 ADORA3 (0.49) POLBKMT2AALDH1A1ADORA3ADORA1
SCHEMBL14670859 0.73 L3MBTL1 (0.61) POLBKMT2AALDH1A1NR4A1RAB9A

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
US-7605215-B2 Process for producing olefin copolymerization catalyst and process for producing olefin copolymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-10-20 US disclosed
US-20080227937-A1 Process for Producing Olefin Copolymerization Catalyst and Process for Producing Olefin Copolymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-09-18 US disclosed