SCHEMBL20433247

SCHEMBL20433247

Cc1ccc(-c2cnc(N)c(-c3nnc(-c4ccc(CN)cc4F)o3)n2)cc1

nearest known ligand 0.52

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ATR Q13535 20/20 0.52

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
SCHEMBL19672764 0.89 ATR (0.59) ATR
SCHEMBL20433551 0.88 ATR (0.51) ATR
SCHEMBL20433015 0.84 ATR (0.55) ATR
SCHEMBL20433394 0.84 ATR (0.51) ATR
SCHEMBL24681209 0.84 ATR (0.51) ATR
SCHEMBL20433211 0.84 ATR (0.51) ATR
SCHEMBL20433623 0.84 ATR (0.51) ATR
SCHEMBL20433678 0.79 ATR (0.55) ATR
SCHEMBL20433784 0.78 ATR (0.50) ATR
SCHEMBL20433125 0.77 ATR (0.61) ATR

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-3354650-A1 COMPOUNDS USEFUL AS INHIBITORS OF ATR KINASE Vertex Pharmaceuticals Incorporated (US) 2018-08-01 EP disclosed