SCHEMBL1757650

SCHEMBL1757650

CN(C)c1ccc(C2SCCCS2)cc1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.51
TDP1 Q9NUW8 3/20 0.51
MAPT P10636 2/20 0.51
TSHR P16473 4/20 0.44
ALOX15 P16050 3/20 0.44
HSD17B10 Q99714 1/20 0.44
PDGFRB P09619 1/20 0.38
POLB P06746 1/20 0.38
RECQL P46063 1/20 0.37
SLC18A3 Q16572 1/20 0.37
MAPK1 P28482 3/20 0.37
CYP3A4 P08684 2/20 0.37
TP53 P04637 1/20 0.37
KDM4E B2RXH2 1/20 0.37
ATM Q13315 1/20 0.37
CYP1A2 P05177 1/20 0.36
GAA P10253 1/20 0.35

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
Iodide SCHEMBL11769668 0.90 ALDH1A1 (0.53) ALDH1A1TDP1MAPTTSHRALOX15
SCHEMBL7632848 0.82 TSHR (0.44) ALDH1A1TDP1MAPTTSHRPOLB
SCHEMBL2234042 0.79 ALDH1A1 (0.42) ALDH1A1TDP1MAPTTSHRALOX15
SCHEMBL30352396 0.77 KDM4E (0.41) ALDH1A1TDP1MAPTTSHRPOLB
SCHEMBL9271980 0.77 MAPT (0.47) ALDH1A1TDP1MAPTTSHRPOLB
SCHEMBL327401 0.72 ALDH1A1 (0.52) ALDH1A1MAPTTSHRALOX15HSD17B10
SCHEMBL3092932 0.72 MAPT (0.47) ALDH1A1TDP1MAPTTSHRPOLB
SCHEMBL5434824 0.72 MAPT (0.44) ALDH1A1MAPTTSHRPOLBKDM4E
SCHEMBL6694368 0.72 NPC1 (0.44) ALDH1A1TDP1MAPTTSHRPOLB
SCHEMBL2564135 0.72 MAPT (0.47) ALDH1A1TDP1MAPTTSHRPOLB

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 66 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7981990-B2 Synthesis of a liquid polymer and a functionalized polymer BRIDGESTONE CORPORATION (JP) 2011-07-19 US claimed
JP-2010538109-A 2010-12-09 JP claimed
EP-2193150-A2 SYNTHESIS OF A LIQUID POLYMER AND A FUNCTIONALIZED POLYMER Bridgestone Corporation (JP) 2010-06-09 EP claimed
WO-2009032154-A2 SYNTHESIS OF A LIQUID POLYMER AND A FUNCTIONALIZED POLYMER BRIDGESTONE CORPORATION (JP) 2009-03-12 WO claimed
US-20090062451-A1 SYNTHESIS OF A LIQUID POLYMER AND A FUNCTIONALIZED POLYMER BRIDGESTONE CORPORATION (JP) 2009-03-05 US claimed
EP-2193150-B1 SYNTHESIS OF A LIQUID POLYMER AND A FUNCTIONALIZED POLYMER BRIDGESTONE CORP (JP) 2020-09-23 EP disclosed
EP-2193150-B1 SYNTHESIS OF A LIQUID POLYMER AND A FUNCTIONALIZED POLYMER BRIDGESTONE CORP (JP) 2020-09-23 EP disclosed
EP-2266993-B1 The use of sulfur containing initiators for anionic polymerization of monomers BRIDGESTONE CORP (JP) 2017-06-14 EP disclosed
EP-2658898-B1 COUPLED POLYMERS AND METHODS FOR MAKING SAME BRIDGESTONE CORP (JP) 2016-10-12 EP disclosed
US-9441097-B2 Rubber composition and tire produced by using the same BRIDGESTONE CORPORATION (JP) 2016-09-13 US disclosed
US-9441097-B2 Rubber composition and tire produced by using the same BRIDGESTONE CORPORATION (JP) 2016-09-13 US disclosed
US-9441097-B2 Rubber composition and tire produced by using the same BRIDGESTONE CORPORATION (JP) 2016-09-13 US disclosed
US-7153919-B2 Use of sulfur containing initiators for anionic polymerization of monomers BRIDGESTONE CORPORATION (JP) 2006-12-26 US disclosed
WO-2006047328-A1 FUNCTIONALIZED POLYMER WITH LINKING GROUP BRIDGESTONE CORPORATION (JP) 2006-05-04 WO disclosed
US-20060030657-A1 Use of sulfur containing initiators for anionic polymerization of monomers BRIDGESTONE CORPORATION (JP) 2006-02-09 US disclosed
EP-1565476-A2 THE USE OF SULFUR CONTAINING INITIATORS FOR ANIONIC POLYMERIZATION OF MONOMERS Bridgestone Corporation (JP) 2005-08-24 EP disclosed
WO-2004041870-A2 THE USE OF SULFUR CONTAINING INITIATORS FOR ANIONIC POLYMERIZATION OF MONOMERS BRIDGESTONE CORPORATION (JP) 2004-05-21 WO disclosed
US-4127588-A Sulphur containing derivatives HOFFMANN-LA ROCHE INC. (US) 1978-11-28 US disclosed
US-4073797-A CORONARY DILATOR HOFFMANN-LA ROCHE INC. (US) 1978-02-14 US disclosed
US-4003914-A DITHIANE AND DISULFONE CORONARY DILATING AGENTS HOFFMANN-LA ROCHE INC. (US) 1977-01-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090062451-A1 SYNTHESIS OF A LIQUID POLYMER AND A FUNCTIONALIZED POLYMER FGB, FIP1L1, PUF60 ALDH1A1 1640/4885TDP1 3211/4885MAPT 2672/4885
US-20060030657-A1 Use of sulfur containing initiators for anionic polymerization of monomers TST, ESD, VCL ALDH1A1 3070/4885TDP1 934/4885MAPT 2123/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.