SCHEMBL16648741

SCHEMBL16648741

CC(C)Nc1ncc2c(n1)CN(C(=O)CC(CO)c1ccc(F)c(Cl)c1)CC2

nearest known ligand 0.74

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 20/20 0.74

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
SCHEMBL16649272 0.93 MAPK1 (0.75) MAPK1
SCHEMBL16649364 0.86 MAPK1 (0.67) MAPK1
SCHEMBL16649752 0.85 MAPK1 (0.75) MAPK1
SCHEMBL16649753 0.85 MAPK1 (0.75) MAPK1
SCHEMBL17081777 0.85 MAPK1 (1.00) MAPK1
SCHEMBL12497839 0.83 MAPK1 (0.62) MAPK1
SCHEMBL16649701 0.82 MAPK1 (0.64) MAPK1
SCHEMBL16649874 0.82 MAPK1 (0.64) MAPK1
SCHEMBL17081562 0.82 MAPK1 (1.00) MAPK1
SCHEMBL16649544 0.81 MAPK1 (0.63) MAPK1

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-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
EP-2681215-B1 SERINE/THREONINE KINASE INHIBITORS ARRAY BIOPHARMA INC (US) 2015-04-22 EP disclosed