SCHEMBL30847685

SCHEMBL30847685

CC(C)(C)[Si](C)(C)OCCN1CCN(c2cc(C(F)(F)F)cc(C(F)(F)F)c2OCc2ccccc2)C1=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
KMT2A Q03164 1/20 0.35
DRD3 P35462 4/20 0.34
DRD2 P14416 3/20 0.34
KCNH2 Q12809 3/20 0.34
AR P10275 1/20 0.34
SCN9A Q15858 4/20 0.33
TACR1 P25103 1/20 0.32
GRM5 P41594 1/20 0.32
GRM3 Q14832 1/20 0.32
RPS6KB1 P23443 1/20 0.31
MAOB P27338 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
PARP1 P09874 1/20 0.31
PARP2 Q9UGN5 1/20 0.31
ELANE P08246 1/20 0.31
FEN1 P39748 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
SCHEMBL30847726 0.84 DRD2 (0.38) MEN1ALDH1A1KMT2ADRD3DRD2
SCHEMBL30847667 0.82 POLQ (0.36) MEN1ALDH1A1KMT2ADRD3DRD2
SCHEMBL30847656 0.81 DRD2 (0.34) DRD3DRD2KCNH2SCN9A
SCHEMBL30847744 0.80 AR (0.36) MEN1ALDH1A1KMT2ADRD3DRD2
SCHEMBL30847704 0.80 AR (0.36) MEN1ALDH1A1KMT2ADRD3DRD2
SCHEMBL30847657 0.76 SCN5A (0.43) SCN9ATACR1
SCHEMBL5660117 0.73 DRD2 (0.51) MEN1KMT2ADRD3DRD2KCNH2
SCHEMBL30847650 0.73 ALOX5 (0.39) MEN1ALDH1A1KMT2AARTACR1
SCHEMBL30847795 0.70 CYP1A2 (0.41) MEN1ALDH1A1KMT2ATACR1RPS6KB1
SCHEMBL15898917 0.69 TACR1 (0.36) MEN1ALDH1A1KMT2AARTACR1

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