SCHEMBL9749218

SCHEMBL9749218

Cc1[c]sc(SC2(C(=O)O)CCC2)n1

nearest known ligand 0.38

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 20/20 0.38

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
SCHEMBL10688618 0.69 SLC22A12 (0.35) SLC22A12
SCHEMBL4446097 0.61 SLC22A12 (0.34) SLC22A12
SCHEMBL17153412 0.60
SCHEMBL2657497 0.58 SLC22A12 (0.43) SLC22A12
SCHEMBL8604937 0.57 SLC22A12 (0.50) SLC22A12
SCHEMBL15730059 0.56 FFAR3 (0.33) SLC22A12
SCHEMBL15729969 0.56 CYP2C19 (0.35) SLC22A12
SCHEMBL4966169 0.55 SLC22A12 (0.43) SLC22A12
SCHEMBL3058072 0.55 SLC22A12 (0.48) SLC22A12
SCHEMBL18793 0.55 CYP2C19 (0.38) SLC22A12

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
EP-0194572-B1 HETEROCYCLIC SULFIDES, PROCESS FOR THEIR PREPARATION AND MEDICAMENTS CONTAINING THEM HOECHST AKTIENGESELLSCHAFT (DE) 1992-01-02 EP disclosed