SCHEMBL31009150

SCHEMBL31009150

[2H]C([2H])([2H])N(C(=O)Oc1c(-n2ccn(C(=O)OC(C)(C)C)c2=O)cc(C(F)(F)F)cc1C(F)(F)F)c1ccc(F)cc1

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
POLQ O75417 2/20 0.41
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
TACR1 P25103 3/20 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
SCHEMBL30847572 0.94 POLQ (0.39) POLQMEN1KMT2ATACR1
SCHEMBL29314473 0.94 POLQ (0.39) POLQMEN1KMT2ATACR1
SCHEMBL31009168 0.84 POLQ (0.34) POLQ
SCHEMBL29315670 0.84 POLQ (0.35) POLQTACR1
SCHEMBL31009196 0.84 POLQ (0.35) POLQTACR1
SCHEMBL31009165 0.80 POLQ (0.46) POLQ
SCHEMBL30847634 0.80 POLQ (0.48) POLQ
SCHEMBL31009194 0.79 POLQ (0.44) POLQ
SCHEMBL30847773 0.77 POLQ (0.48) POLQTACR1
SCHEMBL29313609 0.77 POLQ (0.40) 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