SCHEMBL19493600

SCHEMBL19493600

COc1n[nH]c2cc(Cl)nc(Cl)c12

nearest known ligand 0.37

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 20/20 0.37

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
SCHEMBL19493599 0.88 MAPK1 (0.41) MAPK1
SCHEMBL19494134 0.85 MAPK1 (0.41) MAPK1
SCHEMBL19494150 0.81 MAPK1 (0.51) MAPK1
SCHEMBL19494135 0.80 MAPK1 (0.36) MAPK1
SCHEMBL7702341 0.77 ADORA2A (0.33) —
SCHEMBL16830112 0.73 GRM4 (0.30) —
SCHEMBL16516791 0.73 GRM4 (0.30) —
SCHEMBL30596252 0.73 GRM4 (0.30) —
SCHEMBL16964858 0.69 MAPK1 (0.46) MAPK1
SCHEMBL31144193 0.69 MAPK1 (0.46) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2900223-B1 NOVEL COMPOUNDS THAT ARE ERK INHIBITORS MERCK SHARP & DOHME (US) 2017-10-25 — — EP disclosed
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