SCHEMBL11129083

SCHEMBL11129083

CN(C(=O)c1cccs1)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.53
CES1 P23141 1/20 0.53
KMT2A Q03164 5/20 0.53
KDM4E B2RXH2 1/20 0.53
DAO P14920 1/20 0.52
MEN1 O00255 3/20 0.51
HTT P42858 2/20 0.51
HPGDS O60760 1/20 0.50
POLB P06746 1/20 0.49
RAB9A P51151 3/20 0.47
NPC1 O15118 2/20 0.47
HSD17B10 Q99714 1/20 0.47
MAPT P10636 2/20 0.47
LMNA P02545 2/20 0.46
ALOX15 P16050 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CHRM2 P08172 1/20 0.45
CHRM3 P20309 1/20 0.45

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
SCHEMBL5644421 0.86 SMN1; SMN2 (0.57) KMT2AMEN1HTTRAB9ANPC1
SCHEMBL23610329 0.85 LMNA (0.52) CES2CES1KMT2ADAOMEN1
SCHEMBL3857509 0.84 ALOX15 (0.62) CES2CES1KMT2AKDM4EDAO
Water SCHEMBL11223712 0.83 CES2 (0.52) CES2CES1KMT2ADAOMEN1
Water SCHEMBL11223711 0.83 HTT (0.47) CES2CES1KMT2ADAOMEN1
SCHEMBL28992360 0.81 CES2 (0.57) CES2CES1KMT2AKDM4EDAO
SCHEMBL8888712 0.81 HTT (0.48) CES2CES1KMT2AKDM4EDAO
SCHEMBL827527 0.79 CES2 (0.64) CES2CES1KMT2ADAOMEN1
SCHEMBL6630311 0.79 HTT (0.60) KMT2AKDM4EMEN1HTTRAB9A
SCHEMBL28504507 0.79 DAO (0.42) CES2CES1KMT2AKDM4EDAO

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
JP-58018375-A None JP disclosed
US-12188139-B2 Alternating current electrolysis for use in organic synthesis WAYNE STATE UNIVERSITY (US) 2025-01-07 US disclosed
US-20230091947-A1 ALTERNATING CURRENT ELECTROLYSIS FOR USE IN ORGANIC SYNTHESIS WAYNE STATE UNIVERSITY (US) 2023-03-23 US disclosed
US-11499238-B2 Alternating current electrolysis for use in organic synthesis WAYNE STATE UNIVERSITY (US) 2022-11-15 US disclosed
US-20210207274-A1 ALTERNATING CURRENT ELECTROLYSIS FOR USE IN ORGANIC SYNTHESIS WAYNE STATE UNIVERSITY (US) 2021-07-08 US disclosed
JP-S5818375-A THIOPHENECARBONANILIDE DERIVATIVE AND FUNGICIDE CONTAINING THE SAME KUMIAI CHEM IND CO LTD 1983-02-02 JP disclosed