SCHEMBL11424232

SCHEMBL11424232

CC1=CSCC(C(=O)O)=N1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.31
PKM P14618 1/20 0.31
HCAR2 Q8TDS4 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
SCHEMBL11499711 0.79 NPSR1 (0.33) KDM4E
SCHEMBL11424235 0.68 KDM4E (0.31) KDM4EPKMHCAR2
SCHEMBL20031230 0.65 NOTUM (0.30)
SCHEMBL11419666 0.63
SCHEMBL1311693 0.63
SCHEMBL14472921 0.60 HCAR2 (0.33) HCAR2
SCHEMBL27682010 0.57
SCHEMBL31367006 0.56 KDM4E (0.31) KDM4EPKMHCAR2
Terephthalic Acid SCHEMBL31728631 0.47 TSHR (0.67)
SCHEMBL30770833 0.47

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-55022648-A None JP disclosed
US-4282235-A Derivatives of thiazolidinecarboxylic acids and related acids E. R. SQUIBB & SONS, INC. (US) 1981-08-04 US disclosed
US-4237134-A ANGIOTENSIN CONVERTING ENZYME INHIBITORS E. R. SQUIBB & SONS, INC. (US) 1980-12-02 US disclosed
US-4237129-A Derivatives of thiazolidinecarboxylic acids and related acids E. R. SQUIBB & SONS, INC. (US) 1980-12-02 US disclosed
US-4192878-A HYPOTENSIVE AGENTS E. R. SQUIBB & SONS, INC. (US) 1980-03-11 US disclosed
JP-S5522648-A PREPARATIN OF 5-METHYL-1,4-THIAZAN-3-CARBOXYLIC ACID TANABE SEIYAKU CO LTD 1980-02-18 JP disclosed