SCHEMBL4625286

SCHEMBL4625286

C=C(C)C(O)=S.C=C(C)C(O)=S

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.35
ALDH1A1 P00352 2/20 0.31
TP53 P04637 1/20 0.31
TSHR P16473 1/20 0.31

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
SCHEMBL176354 1.00
SCHEMBL5347394 1.00 TDP1 (0.35) TDP1ALDH1A1TP53TSHR
Hydrochloric Acid SCHEMBL11753357 0.96
Benzene SCHEMBL17022337 0.92 TAS2R38 (0.33) TDP1ALDH1A1
SCHEMBL11753346 0.78
SCHEMBL6840418 0.76
SCHEMBL8584045 0.76
SCHEMBL21437104 0.76
SCHEMBL9246660 0.73
SCHEMBL2384524 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1359170-B1 PHOTOCHROMIC CURABLE COMPOSITION AND CURED ARTICLES THEREOF TOKUYAMA CORP (JP) 2008-07-30 EP disclosed
US-7393880-B2 Radically polymerizable composition resulting in shock resistant organic lenses ESSILOR INTERNATIONAL COMPAGNIE GENERALE D'OPTIQUE (FR) 2008-07-01 US disclosed
US-7087195-B2 Photochromic curable composition and cured articles thereof TOKUYAMA CORPORATION (JP) 2006-08-08 US disclosed
US-20050107537-A1 Composition capable of free radical polymerization resulting in shockproof organic glass materials ESSILOR INTERNATIONAL COMPAGNIE GENERALE D'OPTIQUE (FR) 2005-05-19 US disclosed
EP-1453874-A1 COMPOSITION CAPABLE OF FREE RADICAL POLYMERIZATION RESULTING IN SHOCKPROOF ORGANIC GLASS MATERIALS ESSILOR INTERNATIONAL COMPAGNIE GENERALE D'OPTIQUE (FR) 2004-09-08 EP disclosed
US-6777494-B1 POLYTHIOURETHANE AND POLYTHIOETHER POLYMERS FORMED MAY BE USED ALONE OR MIXED FOR OPTICAL PURPOSES SUCH AS THE MANUFACTURE OF OPHTHALMIC LENSES OPTIMA INC. 2004-08-17 US disclosed
US-20040046156-A1 Photochromic curable composition and cured articles thereof TOKUYAMA CORPORATION (JP) 2004-03-11 US disclosed
EP-1359170-A1 PHOTOCHROMIC CURABLE COMPOSITION AND CURED ARTICLES THEREOF TOKUYAMA CORPORATION (JP) 2003-11-05 EP disclosed
WO-2003046028-A1 COMPOSITION CAPABLE OF FREE RADICAL POLYMERIZATION RESULTING IN SHOCKPROOF ORGANIC GLASS MATERIALS ESSILOR INTERNATIONAL COMPAGNIE GENERALE D'OPTIQUE (FR) 2003-06-05 WO disclosed
US-6008296-A CURABLE MONOMER COMPOSITION COMPRISING A POLYISOCYANATE OR POLYTHIOISOCYANATE, POLYTHIOL, AND POLYENE OF GIVEN FORMULA; NO PHASE SEPERATION, SINGLE GLASS TRANSITION TEMPERATURE, IMPACT RESISTANCE AND HIGH REFRACTIVE INDEX FOR EYEGLASSES OPTIMA, INC. (US) 1999-12-28 US disclosed
US-4665180-A Substituted tetrahydropyrimidines and octahydrophenanthridines PETROLITE CORPORATION (US) 1987-05-12 US disclosed