SCHEMBL7243238

SCHEMBL7243238

CN(C)C(=O)SC(O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
MAPK1 P28482 1/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 2/20 0.41
GAA P10253 1/20 0.39
AOC3 Q16853 6/20 0.39
HPGD P15428 1/20 0.39
CYP2D6 P10635 1/20 0.39

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
SCHEMBL8442402 0.75 TSHR (0.40) LMNAMEN1KMT2AALDH1A1KDM4E
SCHEMBL22519675 0.68 LMNA (0.46) LMNAMAPK1MEN1KMT2AALDH1A1
SCHEMBL1268813 0.68 LMNA (0.46) LMNAMAPK1MEN1KMT2AALDH1A1
SCHEMBL27561623 0.67 CYP2D6 (0.44) LMNAMAPK1KMT2AKDM4EAOC3
Diphenamide SCHEMBL39339 0.67 ALDH1A1 (0.55) MEN1KMT2AALDH1A1KDM4ECYP2D6
Diphenamide SCHEMBL6910614 0.67 ALDH1A1 (0.55) MEN1KMT2AALDH1A1KDM4ECYP2D6
Diphenamide SCHEMBL9202269 0.67 ALDH1A1 (0.55) MEN1KMT2AALDH1A1KDM4ECYP2D6
SCHEMBL7776861 0.67 ALDH1A1 (0.45) MEN1KMT2AALDH1A1HPGD
SCHEMBL3648024 0.67 ALDH1A1 (0.46) LMNAMAPK1MEN1KMT2AALDH1A1
SCHEMBL28106402 0.66 LMNA (0.44) LMNAMAPK1MEN1KMT2AALDH1A1

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
US-6630578-B2 Which respond immediately by emission of light when stimulated with light or electric energy, and are useful as switching material of memory COMMUNICATIONS RESEARCH LABORATORY, INDEPENDENT ADMINISTRATIVE INSTITUTION (JP) 2003-10-07 US disclosed
US-20020072583-A1 Novel thioether derivatives, their method for production and use NATIONAL INSTITUTE OF INFORMATION AND COMMUNICATIONS TECHNOLOGY, INCORPORATED ADMINISTRATIVE AGENCY (JP) 2002-06-13 US disclosed