SCHEMBL21541547

SCHEMBL21541547

[CH2]n1cc(-c2ccn(Cc3cc(F)cc(Br)c3)c(=O)c2)c2cc(N3CCOCC3)cnc21

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 18/20 0.49
▸ STAT6 P42226 1/20 0.41
▸ CHEK1 O14757 1/20 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
SCHEMBL21541551 0.91 MAPK1 (0.53) MAPK1
SCHEMBL25970919 0.91 MAPK1 (0.49) MAPK1STAT6
SCHEMBL21541563 0.91 MAPK1 (0.52) MAPK1STAT6
SCHEMBL21557921 0.91 MAPK1 (0.49) MAPK1STAT6CHEK1
SCHEMBL21541562 0.89 MAPK1 (0.54) MAPK1
SCHEMBL20503855 0.87 MAPK1 (0.46) MAPK1STAT6CHEK1
SCHEMBL20503858 0.86 MAPK1 (0.45) MAPK1STAT6CHEK1
SCHEMBL21541548 0.85 MAPK1 (0.59) MAPK1
SCHEMBL21541557 0.85 MAPK1 (0.57) MAPK1
SCHEMBL20503875 0.85 MAPK1 (0.46) MAPK1STAT6CHEK1

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-3377491-B1 AZAINDOLE DERIVATIVES AND THEIR USE AS ERK KINASE INHIBITORS AGV DISCOVERY (FR) 2019-11-13 — — EP claimed
Send feedback