SCHEMBL4713847

SCHEMBL4713847

Cc1c[nH]c(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5nccs5)n4)c3)cc(C(F)(F)F)c2)n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 12/20 0.56
KIT P10721 7/20 0.56
PDGFRB P09619 4/20 0.56
LDLR P01130 3/20 0.56
PCSK9 Q8NBP7 3/20 0.56
SRC P12931 5/20 0.54
BCR P11274 4/20 0.54
PDGFRA P16234 4/20 0.54
ADORA3 P0DMS8 2/20 0.54
ABL2 P42684 2/20 0.54
LCK P06239 2/20 0.54
LYN P07948 2/20 0.54
FLT3 P36888 2/20 0.54
DDR2 Q16832 2/20 0.54
EPHB6 O15197 1/20 0.54
CA12 O43570 1/20 0.54
CACNA1F O60840 1/20 0.54
SLC22A3 O75751 1/20 0.54
STK10 O94804 1/20 0.54
CA1 P00915 1/20 0.54

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
SCHEMBL3362592 0.88 ABL1 (0.58) ABL1KITPDGFRBLDLRPCSK9
SCHEMBL1005305 0.86 ABL1 (0.72) ABL1KITPDGFRBLDLRPCSK9
SCHEMBL4710149 0.86 ABL1 (0.70) ABL1KITPDGFRBLDLRPCSK9
Hydrochloric Acid SCHEMBL4600295 0.86 ABL1 (0.71) ABL1KITPDGFRBLDLRPCSK9
Hydrochloric Acid SCHEMBL1754053 0.85 ABL1 (0.70) ABL1KITPDGFRBLDLRPCSK9
SCHEMBL3949771 0.83 KIT (0.78) ABL1KITPDGFRBLDLRPCSK9
SCHEMBL3949140 0.81 CSF1R (0.59) ABL1KITPDGFRBLDLRPCSK9
SCHEMBL2939682 0.79 BRAF (0.57) ABL1KITPDGFRBSRCBCR
SCHEMBL1653905 0.76 ABL1 (0.76) ABL1KITPDGFRBLDLRPCSK9
SCHEMBL17316222 0.75 ABL1 (0.49) ABL1KITLDLRPCSK9SRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1922309-A1 N-PHENYL-2-PYRIMIDINE-AMINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF Il Yang Pharm. Co. Ltd. (KR) 2008-05-21 EP claimed
WO-2007018325-A1 N-PHENYL-2-PYRIMIDINE-AMINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF IL-YANG PHARM. CO., LTD. (KR) 2007-02-15 WO claimed
EP-1922309-A1 N-PHENYL-2-PYRIMIDINE-AMINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF Il Yang Pharm. Co. Ltd. (KR) 2008-05-21 EP disclosed
WO-2007018325-A1 N-PHENYL-2-PYRIMIDINE-AMINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF IL-YANG PHARM. CO., LTD. (KR) 2007-02-15 WO disclosed