SCHEMBL29313663

SCHEMBL29313663

CN(C(=O)Oc1c(-n2ccn(C#CC3CC3)c2=O)cc(C(F)(F)F)cc1C(F)(F)F)c1ccc(F)cc1

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
POLQ O75417 2/20 0.36
TACR1 P25103 1/20 0.30
CMA1 P23946 1/20 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
SCHEMBL29313612 0.88 POLQ (0.38) POLQCMA1
SCHEMBL29313613 0.87 POLQ (0.38) POLQCMA1
SCHEMBL29313610 0.87 POLQ (0.39) POLQCMA1
SCHEMBL29313609 0.87 POLQ (0.40) POLQCMA1
SCHEMBL29313619 0.83 POLQ (0.36) POLQ
SCHEMBL29313664 0.83 POLQ (0.35) POLQ
SCHEMBL29313708 0.83 POLQ (0.38) POLQTACR1
SCHEMBL29313614 0.82 POLQ (0.34) POLQ
SCHEMBL29313667 0.82 POLQ (0.34) POLQ
SCHEMBL29313662 0.82 POLQ (0.34) 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