SCHEMBL28027211

SCHEMBL28027211

CS(=O)(=O)OCc1ccoc1CO

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
TP53 P04637 1/20 0.31

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
SCHEMBL7356491 0.77 TDP1 (0.34) TP53
SCHEMBL8385405 0.74
Methoxymethane SCHEMBL28440091 0.72 PDE4A (0.33) TP53
SCHEMBL39411 0.71
SCHEMBL985442 0.71 KDM4E (0.38)
SCHEMBL9593533 0.71 CA2 (0.33) CYP1A2CYP3A4CYP2D6
Ether SCHEMBL29157023 0.68 CYP4F2 (0.31)
SCHEMBL5273095 0.68 CYP1A2 (0.41) CYP1A2CYP3A4CYP2D6
SCHEMBL22211333 0.67 CA2 (0.48) CYP1A2CYP3A4CYP2D6
SCHEMBL16830300 0.67 ALDH1A1 (0.40) CYP1A2CYP3A4CYP2D6TP53

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
CN-105189751-B Bridged bicyclic nucleosides 米拉根医疗股份有限公司 2019-04-23 CN disclosed
CN-105189751-A Bridged bicyclic nucleosides MIRAGEN THERAPEUTICS INC 2015-12-23 CN disclosed