SCHEMBL23140671

SCHEMBL23140671

O=C(CS(=O)(=O)O)SC1CC2CCC1C2

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.38
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
HIF1A Q16665 1/20 0.36
HSD17B10 Q99714 1/20 0.36
POLB P06746 1/20 0.34
EPHX1 P07099 1/20 0.31
HTT P42858 1/20 0.30
HSD11B1 P28845 1/20 0.30

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
SCHEMBL23143114 0.75 CYP1A2 (0.37) EPHX2CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL3080573 0.74 POLB (0.38) EPHX2CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL23143050 0.74 CYP1A2 (0.39) EPHX2CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL24249563 0.72 POLB (0.37) EPHX2POLBEPHX1HSD11B1
SCHEMBL23143123 0.70 POLB (0.49) EPHX2CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL23143084 0.68 POLB (0.46) EPHX2CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL17717501 0.67 CYP19A1 (0.50) EPHX2CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL3069400 0.66 MAPT (0.34) POLB
SCHEMBL17703637 0.66 POLB (0.41) EPHX2CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL18775645 0.66 CYP1A2 (0.38) EPHX2CYP1A2CYP2D6CYP2C9CYP2C19

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
US-20210088905-A1 ACTINIC RAY-SENSITIVE OR RADIATION-SENSITIVE RESIN COMPOSITION, RESIST FILM, PATTERN FORMING METHOD, AND METHOD FOR MANUFACTURING ELECTRONIC DEVICE FUJIFILM CORPORATION (JP) 2021-03-25 US disclosed