SCHEMBL30847622

SCHEMBL30847622

CN(C(=O)Oc1c(Cl)cc(Cl)cc1I)c1ccc(F)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPE Q05469 5/20 0.39
MAPT P10636 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
LMNA P02545 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ACLY P53396 1/20 0.36
FSCN1 Q16658 1/20 0.35
ALDH1A1 P00352 2/20 0.35
GPBAR1 Q8TDU6 2/20 0.35
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.35
GLA P06280 1/20 0.35
GAA P10253 1/20 0.35
RAB9A P51151 1/20 0.35
CHRNB2 P17787 1/20 0.34
CHRNB4 P30926 1/20 0.34
CHRNA3 P32297 1/20 0.34
CHRNA4 P43681 1/20 0.34
CYP3A4 P08684 1/20 0.34
MEN1 O00255 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
SCHEMBL30847644 0.85 POLQ (0.41) LIPEMAPTSMN1; SMN2LMNAL3MBTL1
SCHEMBL30847641 0.75 POLQ (0.43) LIPESMN1; SMN2LMNAALDH1A1GPBAR1
SCHEMBL29314388 0.74 POLQ (0.50) LIPESMN1; SMN2LMNAALDH1A1GAA
SCHEMBL30847681 0.73 DRD3 (0.37) RAB9A
SCHEMBL4644625 0.71 POLB (0.47) MAPTSMN1; SMN2LMNAFSCN1ALDH1A1
SCHEMBL10797709 0.68 RAB9A (0.47) LIPEMAPTSMN1; SMN2LMNAL3MBTL1
SCHEMBL4644619 0.68 CA1 (0.36) MAPTLMNAL3MBTL1ALDH1A1KDM4E
SCHEMBL30847603 0.67 SMN1; SMN2 (0.60) LIPEMAPTSMN1; SMN2LMNAL3MBTL1
SCHEMBL9579561 0.67 CA1 (0.33) MAPTL3MBTL1ALDH1A1KMT2APOLB
SCHEMBL4642631 0.67 KMT2A (0.34) MAPTLMNAL3MBTL1FSCN1ALDH1A1

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