SCHEMBL16649609

SCHEMBL16649609

CCCC(CC(=O)N1CCc2cnc(NC(C)C)nc2C1)c1ccc(C(F)(F)F)c(F)c1

nearest known ligand 0.69

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 20/20 0.69
CDK2 P24941 2/20 0.64

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
SCHEMBL16649456 0.94 MAPK1 (0.73) MAPK1CDK2
SCHEMBL17081788 0.83 MAPK1 (0.61) MAPK1CDK2
SCHEMBL17081582 0.83 MAPK1 (0.85) MAPK1CDK2
SCHEMBL17081506 0.81 MAPK1 (0.84) MAPK1CDK2
SCHEMBL16649364 0.80 MAPK1 (0.67) MAPK1
SCHEMBL17081636 0.80 MAPK1 (1.00) MAPK1CDK2
SCHEMBL16649753 0.80 MAPK1 (0.75) MAPK1
SCHEMBL16649752 0.80 MAPK1 (0.75) MAPK1
SCHEMBL16648741 0.79 MAPK1 (0.74) MAPK1
Hydrochloric Acid SCHEMBL12498143 0.79 MAPK1 (0.98) MAPK1CDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2681215-B1 SERINE/THREONINE KINASE INHIBITORS ARRAY BIOPHARMA INC (US) 2015-04-22 EP claimed
US-9133187-B2 Serine/threonine kinase inhibitors ARRAY BIOPHARMA INC. (US) 2015-09-15 US disclosed