SCHEMBL29313701

SCHEMBL29313701

CNCC(Cn1ccn(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2OC(=O)N(C)c2ccc(F)cc2)c1=O)OC

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
POLQ O75417 2/20 0.37
CMA1 P23946 2/20 0.32
MAPT P10636 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31

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
SCHEMBL29313698 0.92 POLQ (0.37) POLQCMA1
SCHEMBL29313704 0.86 POLQ (0.39) POLQCMA1MAPTRXFP1
SCHEMBL29313752 0.83 POLQ (0.38) POLQCMA1MAPTRXFP1
SCHEMBL29313751 0.82 POLQ (0.39) POLQCMA1MAPTRXFP1
SCHEMBL29313795 0.80 POLQ (0.38) POLQ
SCHEMBL29313749 0.80 POLQ (0.38) POLQ
SCHEMBL29313744 0.80 POLQ (0.38) POLQMAPTRXFP1
SCHEMBL29313799 0.79 POLQ (0.37) POLQ
SCHEMBL29313794 0.79 POLQ (0.37) POLQMAPT
SCHEMBL29313609 0.78 POLQ (0.40) POLQCMA1

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