SCHEMBL6640452

SCHEMBL6640452

CC(C)CCn1c(=O)c(F)cc2cnc(Nc3ccc(N4CCC(O)CC4)cc3)cc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 1/20 0.46
FYN P06241 3/20 0.46
CDK4 P11802 6/20 0.45
CCND1 P24385 5/20 0.45
CCND2 P30279 2/20 0.45
CCND3 P30281 2/20 0.45
FGFR1 P11362 3/20 0.44
CCNA2 P20248 2/20 0.44
CDK2 P24941 2/20 0.44
WEE1 P30291 2/20 0.44
FGFR2 P21802 1/20 0.44
FGFR4 P22455 1/20 0.44
FGFR3 P22607 1/20 0.44
SRC P12931 4/20 0.43
LRRK2 Q5S007 2/20 0.41
TNK2 Q07912 1/20 0.40
CDK6 Q00534 1/20 0.40
BTK Q06187 2/20 0.40
DCLK1 O15075 1/20 0.40
LYN P07948 2/20 0.39

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
SCHEMBL6639710 0.90 CDK4 (0.48) FYNCDK4CCND1CCND2CCND3
SCHEMBL6640659 0.90 CDK4 (0.47) FYNCDK4CCND1CCND2CCND3
SCHEMBL6642010 0.90 CDK4 (0.56) MAPK8FYNCDK4CCND1CCND2
SCHEMBL6640998 0.89 CDK4 (0.49) MAPK8FYNCDK4CCND1CCND2
SCHEMBL6639127 0.89 SRC (0.49) MAPK8FYNCDK4CCND1FGFR1
SCHEMBL6640460 0.87 CDK4 (0.55) FYNCDK4CCND1CCND2CCND3
SCHEMBL6640724 0.86 SYK (0.42) FYNCDK4CCND1CCND2CCND3
SCHEMBL6641109 0.86 FGFR1 (0.54) MAPK8FYNCDK4CCND1FGFR1
SCHEMBL6641940 0.85 MAPK8 (0.47) MAPK8FYNCDK4CCND1CCND2
SCHEMBL6640158 0.85 BTK (0.47) FYNCDK4CCND1CCND2CCND3

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 6 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-A1 NAPHTHYRIDINONES FOR INHIBITING PROTEIN TYROSINE KINASE AND CELL CYCLE KINASE MEDIATED CELLULAR PROLIFERATION WARNER-LAMBERT COMPANY LLC (US) 2000-05-31 EP claimed
WO-1999009030-A1 NAPHTHYRIDINONES FOR INHIBITING PROTEIN TYROSINE KINASE AND CELL CYCLE KINASE MEDIATED CELLULAR PROLIFERATION WARNER-LAMBERT COMPANY (US) 1999-02-25 WO 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