SCHEMBL18360655

SCHEMBL18360655

Cn1cc2cc(-c3n[nH]c4c3CN(C(=O)NC3CCCN(Cc5c(F)cccc5F)C3)CC4)ccc2n1

nearest known ligand 0.71

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.59

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
SCHEMBL15065335 1.00 MAPK1 (0.59) MAPK1
SCHEMBL15065460 0.93 MAPK1 (0.52) MAPK1
SCHEMBL15065273 0.87 MAPK1 (0.55) MAPK1
SCHEMBL15065264 0.86
SCHEMBL807498 0.86
SCHEMBL15065380 0.85 MAPK1 (0.53) MAPK1
SCHEMBL10211864 0.85
SCHEMBL15065337 0.85
SCHEMBL15065403 0.84
SCHEMBL15065255 0.83

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2615916-B1 FUSED PYRAZOLE DERIVATIVES AS NOVEL ERK INHIBITORS MERCK SHARP & DOHME (US) 2017-01-04 EP disclosed