SCHEMBL6638570

SCHEMBL6638570

CCN(CC)CCOc1ccc(Nc2cc3c(cn2)cc(-c2cccs2)c(=O)n3CC)cc1

nearest known ligand 0.77

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SRC P12931 10/20 0.77
BTK Q06187 8/20 0.77
LYN P07948 12/20 0.65
FGFR1 P11362 3/20 0.60
RIPK2 O43353 1/20 0.57
ACVR1 Q04771 1/20 0.57
NOD2 Q9HC29 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
SCHEMBL6642174 0.91 SRC (0.72) SRCBTKLYNFGFR1RIPK2
SCHEMBL6640968 0.87 SRC (1.00) SRCBTKLYNFGFR1RIPK2
SCHEMBL6640140 0.85 SRC (0.80) SRCBTKLYNFGFR1RIPK2
SCHEMBL6640079 0.84 SRC (0.83) SRCBTKLYNFGFR1RIPK2
SCHEMBL6640884 0.83 SRC (0.82) SRCBTKLYNFGFR1RIPK2
SCHEMBL6639181 0.83 SRC (0.77) SRCBTKLYNFGFR1RIPK2
SCHEMBL6638678 0.81 SRC (0.73) SRCBTKLYNFGFR1RIPK2
SCHEMBL6638542 0.81 SRC (0.72) SRCBTKLYNFGFR1RIPK2
SCHEMBL6641442 0.80 SRC (0.71) SRCBTKLYNFGFR1RIPK2
SCHEMBL6640961 0.80 SRC (0.71) SRCBTKLYNFGFR1RIPK2

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-1003745-B1 NAPHTHYRIDINONES FOR INHIBITING PROTEIN TYROSINE KINASE AND CELL CYCLE KINASE MEDIATED CELLULAR PROLIFERATION WARNER LAMBERT CO (US) 2004-12-29 EP claimed
US-6150359-A 1,6-NAPHTHYRIDIONE COMPOUNDS USEFUL FOR TREATING CANCER, RESTENOSIS AND ATHEROSCLEROSIS WARNER-LAMBERT COMPANY (US) 2000-11-21 US claimed
EP-1003745-B1 NAPHTHYRIDINONES FOR INHIBITING PROTEIN TYROSINE KINASE AND CELL CYCLE KINASE MEDIATED CELLULAR PROLIFERATION WARNER LAMBERT CO (US) 2004-12-29 EP disclosed
US-6150359-A 1,6-NAPHTHYRIDIONE COMPOUNDS USEFUL FOR TREATING CANCER, RESTENOSIS AND ATHEROSCLEROSIS WARNER-LAMBERT COMPANY (US) 2000-11-21 US disclosed