SCHEMBL24681797

SCHEMBL24681797

Cc1ncc(-c2ccc(C(=O)N(C)C)cc2)nc1-c1nnc(NC2C=CC=CC2)o1

nearest known ligand 0.58

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ ATR Q13535 20/20 0.58

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
SCHEMBL20433160 0.83 ATR (0.82) ATR
SCHEMBL20433172 0.82 ATR (0.79) ATR
SCHEMBL20433111 0.78 ATR (0.81) ATR
SCHEMBL24680979 0.75 ATR (0.81) ATR
SCHEMBL20433164 0.75 ATR (0.55) ATR
SCHEMBL2484829 0.74 ATR (1.00) ATR
SCHEMBL20433043 0.73 ATR (0.55) ATR
SCHEMBL20433183 0.73 ATR (0.65) ATR
SCHEMBL13137938 0.72 ATR (1.00) ATR
SCHEMBL20432939 0.72 ATR (0.81) 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-4059932-A1 COMPOUNDS USEFUL AS INHIBITORS OF ATR KINASE Vertex Pharmaceuticals Incorporated (US) 2022-09-21 — — EP disclosed
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