SCHEMBL28627896

SCHEMBL28627896

C=CCOC(=O)c1ccc(CSC(=S)S)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SNCA P37840 1/20 0.47
CYP3A4 P08684 3/20 0.43
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
TSHR P16473 2/20 0.38
ALDH1A1 P00352 2/20 0.38
HSD17B10 Q99714 2/20 0.38
CSNK2A2 P19784 1/20 0.35
CSNK2A1 P68400 1/20 0.35
ADRB2 P07550 1/20 0.34
ADRB1 P08588 1/20 0.34
ADRB3 P13945 1/20 0.34
RHOA P61586 1/20 0.34
NPC1 O15118 1/20 0.33
HTT P42858 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
LMNA P02545 1/20 0.33
CYP1A2 P05177 1/20 0.33
MAOA P21397 1/20 0.33

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
SCHEMBL31222822 0.89 SNCA (0.49) SNCACYP3A4MEN1KMT2ATSHR
SCHEMBL8301034 0.83 SNCA (0.49) SNCACYP3A4MEN1KMT2ATSHR
SCHEMBL26784943 0.83 SNCA (0.44) SNCACYP3A4MEN1KMT2ATSHR
SCHEMBL25733579 0.82 SNCA (0.43) SNCACYP3A4MEN1KMT2ATSHR
SCHEMBL28693687 0.80 NPC1 (0.39) CYP3A4MEN1KMT2ATSHRALDH1A1
SCHEMBL27484039 0.80 SNCA (0.51) SNCACYP3A4MEN1KMT2ATSHR
SCHEMBL175786 0.78 SNCA (0.67) SNCACYP3A4MEN1KMT2ATSHR
SCHEMBL28691134 0.76 ADRB2 (0.46) MEN1KMT2AALDH1A1ADRB2ADRB1
SCHEMBL6281110 0.76 SNCA (0.56) SNCACYP3A4MEN1KMT2ATSHR
SCHEMBL12228311 0.76 SNCA (0.56) SNCACYP3A4MEN1KMT2ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113454132-A Ultraviolet-absorbing polymer, resin composition for molding, and molded article 东洋油墨SC控股株式会社 2021-09-28 CN disclosed