SCHEMBL9011618

SCHEMBL9011618

CCOC(=O)c1ccc(NNC(N)=S)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 6/20 0.61
▸ KMT2A Q03164 5/20 0.61
▸ ALDH1A1 P00352 4/20 0.61
▸ GAA P10253 4/20 0.61
▸ MEN1 O00255 4/20 0.61
▸ MAPT P10636 3/20 0.61
▸ KDM4E B2RXH2 1/20 0.61
▸ CA1 P00915 2/20 0.56
▸ CA2 P00918 2/20 0.56
▸ RAB9A P51151 7/20 0.56
▸ NPC1 O15118 4/20 0.56
▸ NPSR1 Q6W5P4 1/20 0.56
▸ CA12 O43570 1/20 0.56
▸ ESR1 P03372 1/20 0.56
▸ CA7 P43166 1/20 0.56
▸ CA9 Q16790 1/20 0.56
▸ ESR2 Q92731 1/20 0.56
▸ CA14 Q9ULX7 1/20 0.56
▸ L3MBTL1 Q9Y468 1/20 0.54
▸ LMNA P02545 1/20 0.54

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
SCHEMBL1615839 0.84 SMN1; SMN2 (0.73) SMN1; SMN2KMT2AALDH1A1GAAMEN1
SCHEMBL14157352 0.84 CA1 (0.62) SMN1; SMN2KMT2AALDH1A1GAAMEN1
SCHEMBL10759919 0.84 MAPT (0.59) SMN1; SMN2KMT2AALDH1A1GAAMEN1
SCHEMBL2384508 0.83 CA1 (0.61) SMN1; SMN2KMT2AALDH1A1GAAMEN1
SCHEMBL5446847 0.79 TSHR (0.73) SMN1; SMN2KMT2AALDH1A1GAAMEN1
SCHEMBL3193204 0.79 LMNA (0.67) SMN1; SMN2KMT2AALDH1A1GAAMEN1
SCHEMBL16797151 0.78 ALDH1A1 (0.58) SMN1; SMN2KMT2AALDH1A1GAAMEN1
SCHEMBL8633952 0.78 SMN1; SMN2 (0.68) SMN1; SMN2KMT2AALDH1A1GAAMEN1
SCHEMBL28849404 0.78 SMN1; SMN2 (0.72) SMN1; SMN2KMT2AALDH1A1GAAMEN1
SCHEMBL306638 0.77 SMN1; SMN2 (0.67) SMN1; SMN2KMT2AALDH1A1GAAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0244526-A1 Novel hypolipidemic and hypocholesteremic compounds and their preparation and use Council of Scientific and Industrial Research (IN) 1987-11-11 — — EP claimed
EP-0447647-B1 Infrared sensitive silver halide photographic elements MINNESOTA MINING & MFG (US) 1996-11-27 — — EP disclosed
US-5232826-A Comprising 5-arylamine-1,2,3,4-thiatriazole compound MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1993-08-03 — — US disclosed
EP-0447647-A2 Infrared sensitive silver halide photographic elements MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1991-09-25 — — EP disclosed
US-4737452-A WITH AROMATIC COMPOUND CONTAINING MERCAPTO AND HYDROZIDE GROUPS FUJI PHOTO FILM CO., LTD. (JP) 1988-04-12 — — US disclosed
US-4731474-A METAL SUBSTITUTED-A-/3-PENTADECYLPHENOXY/ISOBUTYRATE COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 1988-03-15 — — US disclosed
EP-0244526-A1 Novel hypolipidemic and hypocholesteremic compounds and their preparation and use Council of Scientific and Industrial Research (IN) 1987-11-11 — — EP disclosed
EP-0154293-A2 Silver halide photographic materials FUJI PHOTO FILM CO., LTD. (JP) 1985-09-11 — — EP disclosed
Send feedback