SCHEMBL10724349

SCHEMBL10724349

Cc1nccn1Cc1csc(C(=O)CCC(=O)O)c1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ ALPL P05186 2/20 0.38
▸ ALPG P10696 2/20 0.38
▸ ALPI P09923 1/20 0.38
▸ PLAA Q9Y263 1/20 0.38
▸ GFER P55789 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ GLS O94925 1/20 0.37
▸ ESR1 P03372 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ PTGDR2 Q9Y5Y4 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ GRM2 Q14416 1/20 0.35
▸ ALOX5 P09917 1/20 0.35
▸ NOS1 P29475 1/20 0.34
▸ FDPS P14324 1/20 0.34

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
SCHEMBL10730848 0.86 ALPG (0.40) ALPLALPGPLAASMN1; SMN2ALDH1A1
SCHEMBL10727036 0.84 AGTR1 (0.40) L3MBTL1ALPGPLAA
SCHEMBL10724414 0.77 POLB (0.40) LMNAL3MBTL1ALPLALPGALPI
SCHEMBL10650764 0.75 HTT (0.47) LMNAKMT2AGLSSMN1; SMN2ALDH1A1
SCHEMBL10724330 0.75 TBXAS1 (0.54) —
SCHEMBL10646375 0.71 MEN1 (0.44) KMT2ASMN1; SMN2ALDH1A1
SCHEMBL10724345 0.70 TBXAS1 (0.45) SMN1; SMN2FDPS
SCHEMBL10727088 0.70 POLB (0.44) LMNAALPLALPGALPIPLAA
SCHEMBL10724377 0.69 STING1 (0.36) L3MBTL1KMT2A
SCHEMBL6917802 0.69 DAO (0.60) LMNAKMT2AALDH1A1

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-4643998-A Imidazolylalkylthienyl tetrahydropyridazines and processes for their use A. NATTERMAN & CIE GMBH (DE) 1987-02-17 — — US disclosed
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