SCHEMBL27782893

SCHEMBL27782893

Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nc(-c5cccnc5)cs4)c3)cc(C(F)(F)F)c2)c(C)n1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 20/20 0.79
BCR P11274 15/20 0.79
PDGFRB P09619 5/20 0.60
LCK P06239 3/20 0.60
FYN P06241 3/20 0.60
YES1 P07947 3/20 0.60
LYN P07948 3/20 0.60
HCK P08631 3/20 0.60
KIT P10721 3/20 0.60
SRC P12931 3/20 0.60
BRAF P15056 3/20 0.60
NQO2 P16083 3/20 0.60
EPHA3 P29320 3/20 0.60
EPHA8 P29322 3/20 0.60
ABL2 P42684 3/20 0.60
FRK P42685 3/20 0.60
DDR1 Q08345 3/20 0.60
DDR2 Q16832 3/20 0.60
MAP3K20 Q9NYL2 3/20 0.60
CSF1R P07333 2/20 0.60

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
SCHEMBL27804460 0.90 ABL1 (0.79) ABL1BCRPDGFRBLCKFYN
SCHEMBL5023657 0.89 ABL1 (0.80) ABL1BCRPDGFRBLCKFYN
SCHEMBL27782896 0.88 ABL1 (1.00) ABL1BCRPDGFRBLCKFYN
SCHEMBL28784058 0.87 ABL1 (0.80) ABL1BCRPDGFRBLCKFYN
SCHEMBL27782897 0.86 ABL1 (1.00) ABL1BCRPDGFRBLCKFYN
SCHEMBL27783033 0.86 ABL1 (0.81) ABL1BCRPDGFRBLCKFYN
SCHEMBL15453708 0.86 ABL1 (0.80) ABL1BCRPDGFRBLCKFYN
SCHEMBL27804461 0.86 ABL1 (1.00) ABL1BCRPDGFRBLCKFYN
SCHEMBL27804467 0.86 ABL1 (0.82) ABL1BCRPDGFRBLCKFYN
SCHEMBL5029480 0.84 ABL1 (0.73) ABL1BCRPDGFRBLCKFYN

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
CN-101747330-B Pyridyl thiazole amine compound and medicinal composition and application thereof GUANGZHOU INST BIOMED & HEALTH 2012-03-21 CN disclosed
CN-101747330-A Pyridyl thiazole amine compound and medicinal composition and application thereof GUANGZHOU INST BIOMED & HEALTH 2010-06-23 CN disclosed