SCHEMBL7784253

SCHEMBL7784253

COC(=O)CCCCC(CCS)C(=O)CCSC

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.39
L3MBTL1 Q9Y468 1/20 0.37
FOLH1 Q04609 4/20 0.36
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
PABPC1 P11940 1/20 0.33
APOBEC3A P31941 1/20 0.33
APOBEC3G Q9HC16 1/20 0.33
HSD17B10 Q99714 1/20 0.32
SLC1A1 P43005 1/20 0.31
PPARG P37231 1/20 0.31
GLA P06280 1/20 0.31
RNPEP Q9H4A4 1/20 0.30
RECQL P46063 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
SCHEMBL7793680 0.86 LMNA (0.43) FOLH1ALDH1A1LMNA
SCHEMBL7790033 0.86 FOLH1 (0.34) FOLH1
SCHEMBL7793707 0.86 TSHR (0.39) TSHRL3MBTL1FOLH1ALDH1A1LMNA
SCHEMBL7784238 0.84 FOLH1 (0.49) FOLH1ALDH1A1RNPEP
SCHEMBL7793672 0.83 DGKA (0.42) TSHRL3MBTL1ALDH1A1LMNA
SCHEMBL8104568 0.82 TSHR (0.47) TSHRL3MBTL1FOLH1ALDH1A1LMNA
SCHEMBL7793669 0.78 FOLH1 (0.49) FOLH1ALDH1A1LMNARNPEP
SCHEMBL7784245 0.77 TSHR (0.39) TSHRL3MBTL1FOLH1ALDH1A1LMNA
SCHEMBL7794216 0.72 TSHR (0.40) TSHRL3MBTL1FOLH1ALDH1A1LMNA
SCHEMBL7784255 0.72 L3MBTL1 (0.40) TSHRL3MBTL1ALDH1A1LMNAPABPC1

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-0947503-B1 6,8-Dimethylmercaptooctanoic acid derivatives substituted on 6-S and/or 8-S by the 3-methylthiopropanoyl radical and pharmaceutical compositions for the treatment of cancerous tumours GALDERMA RES & DEV (FR) 2001-11-21 EP claimed