SCHEMBL30847641

SCHEMBL30847641

Cc1cc(C(F)(F)F)cc(I)c1OC(=O)N(C)c1ccc(F)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLQ O75417 2/20 0.43
LIPE Q05469 7/20 0.41
LMNA P02545 3/20 0.39
ALDH1A1 P00352 2/20 0.38
RAB9A P51151 2/20 0.38
GAA P10253 2/20 0.38
KDM4E B2RXH2 1/20 0.38
NPC1 O15118 1/20 0.38
GLA P06280 1/20 0.38
TSHR P16473 1/20 0.37
NPSR1 Q6W5P4 2/20 0.36
HTT P42858 1/20 0.36
TLR7 Q9NYK1 1/20 0.36
GPBAR1 Q8TDU6 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
MAPK1 P28482 1/20 0.34
NR1H3 Q13133 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TACR1 P25103 1/20 0.34

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
SCHEMBL29314388 0.92 POLQ (0.50) POLQLIPELMNAALDH1A1RAB9A
SCHEMBL29314384 0.86 POLQ (0.52) POLQLIPELMNAALDH1A1RAB9A
SCHEMBL30847644 0.81 POLQ (0.41) POLQLIPELMNAALDH1A1RAB9A
SCHEMBL30847689 0.78 LIPE (0.39) POLQLIPELMNARAB9AGAA
SCHEMBL30847596 0.77 POLQ (0.50) POLQLIPELMNARAB9AGAA
SCHEMBL30847696 0.77 POLQ (0.36) POLQLIPETACR1
SCHEMBL30847622 0.75 LIPE (0.39) LIPELMNAALDH1A1RAB9AGAA
SCHEMBL29314375 0.74 POLQ (0.47) POLQLIPELMNARAB9ANPSR1
SCHEMBL30847733 0.74 TACR1 (0.44) POLQMEN1KMT2ATACR1
SCHEMBL29314831 0.72 POLQ (0.42) POLQLMNAALDH1A1RAB9AGAA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4598901-A1 PYRROLIDINE AND IMIDAZOLIDINE BASED DNA POLYMERASE THETA INHIBITORS AND USE THEREOF Thomas Jefferson University (US) 2025-08-13 EP disclosed
WO-2024076964-A1 PYRROLIDINE AND IMIDAZOLIDINE BASED DNA POLYMERASE THETA INHIBITORS AND USE THEREOF THOMAS JEFFERSON UNIVERSITY (US) 2024-04-11 WO disclosed