SCHEMBL30656271

SCHEMBL30656271

Cc1ncsc1COc1ccc2sc(C)c(C(=O)NCCN3CCOC3=O)c2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 1/20 0.38
SLC8A1 P32418 3/20 0.35
NQO2 P16083 1/20 0.34
HPGDS O60760 1/20 0.34
DRD2 P14416 1/20 0.33
DRD3 P35462 1/20 0.33
PLAT P00750 1/20 0.33
ESR1 P03372 1/20 0.33
ESR2 Q92731 1/20 0.33
ALDH1A1 P00352 2/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
KMT2A Q03164 1/20 0.33
KDM4E B2RXH2 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CCR5 P51681 1/20 0.32
FSHR P23945 1/20 0.32
HPGD P15428 1/20 0.32

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
SCHEMBL30656256 0.85 NAAA (0.44) SCN9AALDH1A1LMNAPOLBMAPT
SCHEMBL30714645 0.83 SCN9A (0.41) SCN9ASLC8A1NQO2HPGDSPLAT
SCHEMBL30656070 0.81 ALOX5 (0.41) ALDH1A1LMNAPOLBMAPTKMT2A
SCHEMBL30656287 0.80 SCN9A (0.41) SCN9ASLC8A1NQO2HPGDSALDH1A1
SCHEMBL30656127 0.79 SLC6A5 (0.42) LMNA
SCHEMBL30656188 0.79 ALDH1A1 (0.47) ALDH1A1LMNAKMT2AKDM4E
SCHEMBL30656117 0.79 MEN1 (0.37) ESR1ESR2TDP1KMT2A
SCHEMBL30656281 0.78 SLC6A5 (0.39)
SCHEMBL30656116 0.78 EGLN2 (0.35) SCN9ATDP1
SCHEMBL30656161 0.76 EDNRA (0.40) LMNAPOLBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4532013-A1 NEW DERIVATIVES FOR TREATING TRPM3 MEDIATED DISORDERS Katholieke Universiteit Leuven KU Leuven Research & Development (BE) 2025-04-09 EP claimed
CN-119421879-A Novel derivatives for the treatment of TRPM3 mediated disorders 勒芬天主教大学 2025-02-11 CN claimed
WO-2023227697-A1 NEW DERIVATIVES FOR TREATING TRPM3 MEDIATED DISORDERS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2023-11-30 WO claimed
EP-4532013-A1 NEW DERIVATIVES FOR TREATING TRPM3 MEDIATED DISORDERS Katholieke Universiteit Leuven KU Leuven Research & Development (BE) 2025-04-09 EP disclosed
CN-119421879-A Novel derivatives for the treatment of TRPM3 mediated disorders 勒芬天主教大学 2025-02-11 CN disclosed
WO-2023227697-A1 NEW DERIVATIVES FOR TREATING TRPM3 MEDIATED DISORDERS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2023-11-30 WO disclosed