SCHEMBL28709237

SCHEMBL28709237

Cc1ncc(C(=O)Nc2ccc(CCN(C)C)cc2)cc1Nc1nccc(-c2cccnc2)n1

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 12/20 0.61
BCR P11274 9/20 0.61
PDGFRA P16234 12/20 0.60
PDGFRB P09619 5/20 0.60
DDR1 Q08345 1/20 0.60
KIT P10721 5/20 0.59
EGFR P00533 1/20 0.58
PRKCA P17252 1/20 0.58
MAPK8 P45983 1/20 0.57
MAPK9 P45984 1/20 0.57
MAPK10 P53779 1/20 0.57

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
SCHEMBL29551443 1.00 ABL1 (0.61) ABL1BCRPDGFRAPDGFRBDDR1
SCHEMBL24250918 0.92 ABL1 (0.62) ABL1BCRPDGFRAPDGFRBDDR1
SCHEMBL29551241 0.92 ABL1 (0.62) ABL1BCRPDGFRAPDGFRBDDR1
SCHEMBL24250999 0.92 PDGFRA (0.65) ABL1BCRPDGFRAPDGFRBDDR1
SCHEMBL29551463 0.91 ABL1 (0.57) ABL1BCRPDGFRAPDGFRBDDR1
SCHEMBL24251083 0.91 ABL1 (0.57) ABL1BCRPDGFRAPDGFRBDDR1
SCHEMBL24251016 0.90 PDGFRA (0.71) ABL1BCRPDGFRAPDGFRBDDR1
SCHEMBL29551537 0.90 PDGFRA (0.71) ABL1BCRPDGFRAPDGFRBDDR1
SCHEMBL24251078 0.89 ABL1 (0.48) ABL1BCRPDGFRAPDGFRBDDR1
SCHEMBL24251081 0.87 PDGFRA (0.58) ABL1BCRPDGFRAPDGFRBDDR1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114127065-A Compounds for the treatment of neurodegenerative diseases and cancer 鸿仪有限责任公司 2022-03-01 CN claimed