SCHEMBL24251135

SCHEMBL24251135

Cc1ncc(C(=O)Nc2ccc(C3CCN(CC(C)(C)C)C3)cc2)cc1Nc1nccc(-c2cccnc2)n1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 18/20 0.53
BCR P11274 16/20 0.53
KIT P10721 8/20 0.53
PDGFRB P09619 5/20 0.53
PDGFRA P16234 6/20 0.51
EGFR P00533 2/20 0.51
PLK4 O00444 1/20 0.51
DDX3X O00571 1/20 0.51
GAK O14976 1/20 0.51
SLC22A2 O15244 1/20 0.51
MAPK13 O15264 1/20 0.51
CA12 O43570 1/20 0.51
SLC22A3 O75751 1/20 0.51
ABCB11 O95342 1/20 0.51
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
LMNA P02545 1/20 0.51
ALB P02768 1/20 0.51
RAF1 P04049 1/20 0.51
ERBB2 P04626 1/20 0.51

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
SCHEMBL24251136 1.00 ABL1 (0.53) ABL1BCRKITPDGFRBPDGFRA
SCHEMBL24250982 0.93 ABL1 (0.60) ABL1BCRKITPDGFRBPDGFRA
SCHEMBL24251101 0.92 ABL1 (0.55) ABL1BCRKITPDGFRBPDGFRA
SCHEMBL24251100 0.91 ABL1 (0.54) ABL1BCRKITPDGFRBPDGFRA
SCHEMBL24251178 0.90 ABL1 (0.52) ABL1BCRKITPDGFRBPDGFRA
SCHEMBL24250921 0.90 ABL1 (0.52) ABL1BCRKITPDGFRBPDGFRA
SCHEMBL24250927 0.90 ABL1 (0.58) ABL1BCRKITPDGFRBPDGFRA
SCHEMBL24251091 0.89 ABL1 (0.54) ABL1BCRKITPDGFRBPDGFRA
SCHEMBL28699576 0.89 ABL1 (0.55) ABL1BCRKITPDGFRBPDGFRA
SCHEMBL29551550 0.89 ABL1 (0.55) ABL1BCRKITPDGFRBPDGFRA

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