SCHEMBL29313711

SCHEMBL29313711

CN(C(=O)Oc1c(-n2ccn(C3CCNC3)c2=O)cc(C(F)(F)F)cc1C(F)(F)F)c1ccc(F)cc1

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 14/20 0.36
POLQ O75417 4/20 0.35
SLC6A4 P31645 1/20 0.35
P2RX7 Q99572 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
SCHEMBL29313703 0.95 TACR1 (0.39) TACR1POLQSLC6A4
SCHEMBL29313708 0.90 POLQ (0.38) TACR1POLQSLC6A4
SCHEMBL29313707 0.86 TACR1 (0.39) TACR1POLQ
SCHEMBL29313712 0.86 POLQ (0.35) TACR1POLQSLC6A4
SCHEMBL29313696 0.86 POLQ (0.36) TACR1POLQ
SCHEMBL29313695 0.84 POLQ (0.37) POLQ
SCHEMBL29313746 0.83 POLQ (0.35) POLQ
SCHEMBL29313744 0.82 POLQ (0.38) TACR1POLQSLC6A4
SCHEMBL29313743 0.81 POLQ (0.35) POLQ
SCHEMBL29313670 0.81 POLQ (0.35) TACR1POLQ

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