SCHEMBL711232

SCHEMBL711232

C=Cc1ccc(SC(=S)N(CC)CC)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.39
MGLL Q99685 4/20 0.39
PHGDH O43175 3/20 0.39
LMNA P02545 3/20 0.39
ALDH2 P05091 3/20 0.39
HPGD P15428 3/20 0.39
CYP3A4 P08684 2/20 0.39
ABCB11 O95342 2/20 0.39
HTT P42858 2/20 0.39
GSDMD P57764 2/20 0.39
PKM P14618 2/20 0.39
PLIN1 O60240 1/20 0.39
GMNN O75496 1/20 0.39
TRPA1 O75762 1/20 0.39
TP53 P04637 1/20 0.39
CYP1A2 P05177 1/20 0.39
HSP90AA1 P07900 1/20 0.39
HTR1A P08908 1/20 0.39
ADRA2A P08913 1/20 0.39
FBP1 P09467 1/20 0.39

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
Acrylic Acid SCHEMBL710506 0.91 NPC1 (0.43) ALDH1A1MGLLPHGDHLMNAALDH2
SCHEMBL31364230 0.79 ALDH1A1 (0.45) ALDH1A1MGLLPHGDHLMNAALDH2
SCHEMBL711883 0.78 MGLL (0.43) ALDH1A1MGLLPHGDHLMNAALDH2
SCHEMBL5299279 0.77 SMN1; SMN2 (0.56) ALDH1A1MGLLPHGDHLMNAALDH2
SCHEMBL27521010 0.75 SMN1; SMN2 (0.54) ALDH1A1MGLLPHGDHLMNAALDH2
SCHEMBL29009228 0.75 SMN1; SMN2 (0.50) ALDH1A1MGLLPHGDHLMNAALDH2
SCHEMBL24306252 0.74 NPC1 (0.52) ALDH1A1HTTTRPA1MAPTTSHR
SCHEMBL29572243 0.72 ALDH1A1 (0.35) ALDH1A1HTTTRPA1MAPTNPSR1
SCHEMBL24305968 0.72 ALDH1A1 (0.42) ALDH1A1LMNAHTTTRPA1MAPT
SCHEMBL3239653 0.71 ALDH1A1 (0.46) ALDH1A1HTTMAPTTSHRNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8795782-B2 Polymeric coatings and methods for forming them COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2014-08-05 US disclosed
US-20120178165-A1 POLYMERIC COATINGS AND METHODS FOR FORMING THEM COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2012-07-12 US disclosed
US-8124188-B2 Polymeric coatings and methods for forming them COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2012-02-28 US disclosed
WO-2010020008-A1 POLYMER COATINGS POLYMERS CRC LIMITED (AU) 2010-02-25 WO disclosed
EP-2052045-A1 POLYMERIC COATINGS AND METHODS FOR FORMING THEM Commonwealth Scientific and Industrial Research Organisation (AU) 2009-04-29 EP disclosed
WO-2008019450-A1 POLYMERIC COATINGS AND METHODS FOR FORMING THEM COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2008-02-21 WO disclosed
US-20080045686-A1 POLYMERIC COATINGS AND METHODS FOR FORMING THEM COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2008-02-21 US disclosed