SCHEMBL29313614

SCHEMBL29313614

CN(C(=O)Oc1c(-n2ccn(C#Cc3cn[nH]c3)c2=O)cc(C(F)(F)F)cc1C(F)(F)F)c1ccc(F)cc1

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
POLQ O75417 6/20 0.34
LIPE Q05469 2/20 0.30

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
SCHEMBL29313619 0.87 POLQ (0.36) POLQ
SCHEMBL29313620 0.86 POLQ (0.37) POLQ
SCHEMBL29313666 0.85 POLQ (0.40) POLQ
SCHEMBL29313668 0.85 POLQ (0.35) POLQLIPE
SCHEMBL29313662 0.84 POLQ (0.34) POLQ
SCHEMBL29313660 0.84 POLQ (0.34) POLQ
SCHEMBL29313665 0.84 POLQ (0.34) POLQ
SCHEMBL29313612 0.84 POLQ (0.38) POLQLIPE
SCHEMBL29313613 0.84 POLQ (0.38) POLQ
SCHEMBL29313610 0.84 POLQ (0.39) POLQ

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
WO-2024147972-A2 DNA POLYMERASE THETA INHIBITORS CONTAINING NON-SATURATED 5-MEMBERED HETEROCYCLIC RINGS AND USE THEREOF THOMAS JEFFERSON UNIVERSITY (US) 2024-07-11 WO disclosed