SCHEMBL6608523

SCHEMBL6608523

CSc1ncc(C(=O)NCCO)c(Nc2ccc3cn[nH]c3c2)n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 11/20 0.48
PDGFRB P09619 2/20 0.45
PDGFRA P16234 2/20 0.45
MAPK1 P28482 2/20 0.43
HTT P42858 1/20 0.43
RPS6KB1 P23443 2/20 0.43
KDR P35968 2/20 0.42
DAPK3 O43293 2/20 0.42
PRKD3 O94806 2/20 0.42
MAP4K4 O95819 2/20 0.42
PAK4 O96013 2/20 0.42
PIM1 P11309 2/20 0.42
PRKACA P17612 2/20 0.42
CDK2 P24941 2/20 0.42
FLT3 P36888 2/20 0.42
CSNK1A1 P48729 2/20 0.42
CLK2 P49760 2/20 0.42
CDK9 P50750 2/20 0.42
JAK3 P52333 2/20 0.42
CDK5 Q00535 2/20 0.42

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
SCHEMBL6770452 0.92 RPS6KB1 (0.51) SYKMAPK1HTTRPS6KB1JAK3
SCHEMBL6770161 0.91 SYK (0.47) SYKPDGFRBPDGFRAMAPK1HTT
SCHEMBL6777397 0.90 SYK (0.46) SYKPDGFRBPDGFRAMAPK1HTT
SCHEMBL6769860 0.87 SYK (0.52) SYKPDGFRBPDGFRAMAPK1HTT
SCHEMBL6766170 0.86 KDR (0.46) SYKPDGFRBPDGFRAMAPK1HTT
SCHEMBL761284 0.85 SYK (0.54) SYKPDGFRBPDGFRAMAPK1HTT
SCHEMBL6610211 0.85 SYK (0.55) SYKPDGFRBPDGFRAMAPK1RPS6KB1
SCHEMBL6769391 0.84 PDGFRB (0.66) SYKPDGFRBPDGFRAEGFRFGFR1
SCHEMBL7081409 0.84 SYK (0.46) SYKPDGFRBPDGFRAMAPK1HTT
SCHEMBL6772485 0.84 HSD17B10 (0.46) PDGFRBPDGFRALMNAEGFRFLT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1235806-A4 NOVEL 5-PYRIMIDINECARBOXAMIDE DERIVATIVES AND THE PHARMACEUTICAL COMPOSITIONS CONTAINING SAID DERIVATIVES DONG WHA PHARM IND CO LTD (KR) 2004-02-04 EP disclosed
EP-1235806-A1 NOVEL 5-PYRIMIDINECARBOXAMIDE DERIVATIVES AND THE PHARMACEUTICAL COMPOSITIONS CONTAINING SAID DERIVATIVES DONG WHA PHARMACEUTICAL INDUSTRIAL CO. LTD. (KR) 2002-09-04 EP disclosed
WO-2001038308-A1 NOVEL 5-PYRIMIDINECARBOXAMIDE DERIVATIVES AND THE PHARMACEUTICAL COMPOSITIONS CONTAINING SAID DERIVATIVES DONG WHA PHARM. IND. CO., LTD (KR) 2001-05-31 WO disclosed