SCHEMBL6789154

SCHEMBL6789154

CC(C#N)SC(C)C#[N+][S-]

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 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
SCHEMBL2211631 0.79
SCHEMBL17080293 0.68
SCHEMBL8381239 0.60 TSHR (0.47) TSHR
SCHEMBL925795 0.58
SCHEMBL21648892 0.56
Hydrochloric Acid SCHEMBL28186110 0.55
Hydrochloric Acid SCHEMBL28476386 0.55 TSHR (0.90) TSHR
Hydrochloric Acid SCHEMBL22531397 0.55
SCHEMBL24001904 0.55
SCHEMBL9508088 0.55 TSHR (0.39) TSHR

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-6689907-B1 REACTING WITH HYDROSULFIDE AND HYDROGEN SULFIDE, ACIDIFYING ATOFINA (FR) 2004-02-10 US disclosed