SCHEMBL6089242

SCHEMBL6089242

CCC(=O)N1CCN(c2ccc(Nc3ncc4c(n3)C(C(C)C)C(O)=CC4)cc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SYK P43405 10/20 0.53
CDK2 P24941 5/20 0.46
KCNH2 Q12809 1/20 0.46
CDK1 P06493 2/20 0.45
CDK4 P11802 2/20 0.45
CCNB1 P14635 2/20 0.45
CCND1 P24385 2/20 0.45
CCNE1 P24864 2/20 0.45
ALK Q9UM73 2/20 0.44
JAK2 O60674 2/20 0.44
JAK3 P52333 2/20 0.44
JAK1 P23458 1/20 0.44
EGFR P00533 1/20 0.43
MAPT P10636 1/20 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
SCHEMBL6089214 0.92 CDK2 (0.54) SYKCDK2KCNH2CDK1CDK4
SCHEMBL6087486 0.90 ALK (0.56) SYKCDK2CDK4CCND1CCNE1
SCHEMBL6087809 0.89 SYK (0.51) SYKCDK2KCNH2CDK1CDK4
SCHEMBL6087827 0.86 SYK (0.44) SYKCDK2CDK4CCND1CCNE1
SCHEMBL6090969 0.86 CDK4 (0.46) SYKCDK2CDK1CDK4CCNB1
SCHEMBL6088678 0.86 SYK (0.42) SYKCDK2KCNH2CDK1CDK4
SCHEMBL6087383 0.85 SYK (0.54) SYKCDK2CDK1CDK4CCNB1
SCHEMBL7468168 0.84 CDK4 (0.40) SYKCDK2CDK1CDK4CCNB1
SCHEMBL6087196 0.84 CDK4 (0.49) SYKCDK2CDK1CDK4CCNB1
SCHEMBL7471665 0.82 SYK (0.40) SYKCDK2CDK1CDK4CCNB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1235815-A1 QUINAZOLINES AND THEIR USE FOR INHIBITING CYCLIN-DEPENDENT KINASE ENZYMES WARNER-LAMBERT COMPANY (US) 2002-09-04 EP claimed
WO-2001038315-A1 QUINAZOLINES AND THEIR USE FOR INHIBITING CYCLIN-DEPENDENT KINASE ENZYMES WARNER-LAMBERT COMPANY (US) 2001-05-31 WO claimed
US-6982260-B1 Quinazolines and their use for inhibiting cyclin-dependent kinase enzymes WARNER-LAMBERT COMPANY (US) 2006-01-03 US disclosed
EP-1235815-A1 QUINAZOLINES AND THEIR USE FOR INHIBITING CYCLIN-DEPENDENT KINASE ENZYMES WARNER-LAMBERT COMPANY (US) 2002-09-04 EP disclosed
WO-2001038315-A1 QUINAZOLINES AND THEIR USE FOR INHIBITING CYCLIN-DEPENDENT KINASE ENZYMES WARNER-LAMBERT COMPANY (US) 2001-05-31 WO disclosed