SCHEMBL8575765

SCHEMBL8575765

Cc1nnc(SCSC#N)s1

nearest known ligand 0.68

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.47
L3MBTL1 Q9Y468 3/20 0.47
MAPT P10636 1/20 0.46
PKM P14618 1/20 0.46
NPC1 O15118 5/20 0.44
RAB9A P51151 5/20 0.44
LMNA P02545 1/20 0.44
KMT2A Q03164 1/20 0.42
POLB P06746 3/20 0.40
ALDH1A1 P00352 3/20 0.40
HTT P42858 1/20 0.38

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
SCHEMBL9058700 0.86 KMT2A (0.56) NPC1RAB9AKMT2APOLBALDH1A1
SCHEMBL13240158 0.82 GAA (0.59) GAAL3MBTL1MAPTPKMNPC1
SCHEMBL10977302 0.76 GAA (0.53) GAAL3MBTL1MAPTPKMNPC1
SCHEMBL10439061 0.74 GAA (0.47) GAAL3MBTL1MAPTPKMNPC1
SCHEMBL8669334 0.71 KMT2A (0.37) KMT2AALDH1A1
SCHEMBL8443575 0.70
SCHEMBL11458102 0.69 GAA (0.50) GAAL3MBTL1MAPTPKMNPC1
SCHEMBL16363807 0.69 GAA (0.50) GAAL3MBTL1MAPTPKMNPC1
SCHEMBL7036708 0.69 GAA (0.55) GAAL3MBTL1MAPTPKMNPC1
SCHEMBL10401915 0.69 GAA (0.50) GAAL3MBTL1MAPTPKMNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1998001035-A1 THE USE OF 5-ALKYL-1,3,4-OXADIAZOL(AND THIADIAZOL)-2-THIOMETHYLTHIOCYANATES AS MARINE ANTIFOULING AGENTS THE DOW CHEMICAL COMPANY (US) 1998-01-15 WO claimed
US-5631207-A ANTIFOULING AGENTS FOR MARINE ENVIRONMENT THE DOW CHEMICAL COMPANY (US) 1997-05-20 US claimed
WO-1998001035-A1 THE USE OF 5-ALKYL-1,3,4-OXADIAZOL(AND THIADIAZOL)-2-THIOMETHYLTHIOCYANATES AS MARINE ANTIFOULING AGENTS THE DOW CHEMICAL COMPANY (US) 1998-01-15 WO disclosed
US-5631207-A ANTIFOULING AGENTS FOR MARINE ENVIRONMENT THE DOW CHEMICAL COMPANY (US) 1997-05-20 US disclosed