SCHEMBL3086575

SCHEMBL3086575

O=C=NC1CC(N=C=O)SCS1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL331276 0.72 ALDH1A1 (0.36) ALDH1A1
SCHEMBL330777 0.67 ALDH1A1 (0.42) ALDH1A1
SCHEMBL11244333 0.65
SCHEMBL26676794 0.64 ALDH1A1 (0.30) ALDH1A1
SCHEMBL27735153 0.64
SCHEMBL27328672 0.64
SCHEMBL3093523 0.63 ALDH1A1 (0.33) ALDH1A1
SCHEMBL49811 0.61 ALDH1A1 (0.55) ALDH1A1
SCHEMBL48591 0.61 ALDH1A1 (0.55) ALDH1A1
SCHEMBL16628461 0.61 ALDH1A1 (0.41) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100234552-A1 POLYOL COMPOUND, TRANSPARENT MOLDED ARTICLE AND METHOD OF MANUFACTURING TRANSPARENT MOLDED ARTICLE HOYA CORPORATION (JP) 2010-09-16 US disclosed
EP-1637553-B1 TRANSPARENT SHAPED BODY HOYA CORP (JP) 2009-11-25 EP disclosed
US-20060155093-A1 Polyol compound, transparent molded article and method of manufacturing transparent molded article HOYA CORPORATION (JP) 2006-07-13 US disclosed
US-20060149018-A1 Transparent molded article HOYA CORPORATION (JP) 2006-07-06 US disclosed
EP-1640394-A1 POLYOL COMPOUND, TRANSPARENT MOLDED OBJECTS, AND PROCESS FOR PRODUCING TRANSPARENT MOLDED OBJECT HOYA CORPORATION (JP) 2006-03-29 EP disclosed
EP-1637553-A1 TRANSPARENT SHAPED BODY HOYA CORPORATION (JP) 2006-03-22 EP disclosed