SCHEMBL712848

SCHEMBL712848

C=CCN(CC=C)Sc1nc2ccccc2s1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.53
HSD17B10 Q99714 3/20 0.53
HPGD P15428 3/20 0.53
FBP1 P09467 2/20 0.53
ADRA2A P08913 1/20 0.53
ADORA3 P0DMS8 1/20 0.53
DRD2 P14416 1/20 0.53
ALOX15 P16050 1/20 0.53
ADRA2B P18089 1/20 0.53
ADRA2C P18825 1/20 0.53
DRD1 P21728 1/20 0.53
MC5R P33032 1/20 0.53
OPRM1 P35372 1/20 0.53
DRD3 P35462 1/20 0.53
OPRK1 P41145 1/20 0.53
CCR2 P41597 1/20 0.53
HTR6 P50406 1/20 0.53
SLC6A3 Q01959 1/20 0.53
PDK1 Q15118 1/20 0.53
TDP1 Q9NUW8 1/20 0.53

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
SCHEMBL11759780 0.83 L3MBTL1 (0.48) ALDH1A1HSD17B10HPGDFBP1ADRA2A
SCHEMBL3477077 0.82 L3MBTL1 (0.47) ALDH1A1HSD17B10HPGDFBP1ADRA2A
SCHEMBL28286533 0.81 ALDH1A1 (0.59) ALDH1A1HSD17B10HPGDFBP1ADRA2A
SCHEMBL80423 0.80 FBP1 (0.59) ALDH1A1HSD17B10HPGDFBP1ADRA2A
SCHEMBL29494838 0.80 FBP1 (0.59) ALDH1A1HSD17B10HPGDFBP1ADRA2A
SCHEMBL1193419 0.77 FBP1 (0.56) ALDH1A1HSD17B10HPGDFBP1ADRA2A
SCHEMBL4763198 0.77 ALDH1A1 (0.54) ALDH1A1HSD17B10HPGDFBP1ADRA2A
SCHEMBL29494839 0.77 FBP1 (0.56) ALDH1A1HSD17B10HPGDFBP1ADRA2A
SCHEMBL29483757 0.77 ALDH1A1 (0.54) ALDH1A1HSD17B10HPGDFBP1ADRA2A
SCHEMBL29483756 0.77 ALDH1A1 (0.54) ALDH1A1HSD17B10HPGDFBP1ADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8124692-B2 Rubber composition for tire SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2012-02-28 US claimed
US-20100256258-A1 RUBBER COMPOSITION FOR TIRE SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2010-10-07 US claimed
EP-2236502-B1 SULFENAMIDE, VULCANIZATION ACCELERATOR CONTAINING THE SULFENAMIDE FOR RUBBER, AND PROCESS FOR PRODUCING THE VULCANIZATION ACCELERATOR OUCHI SHINKO CHEMICAL IND CO LTD (JP) 2014-03-05 EP disclosed
CN-101878262-B Rubber composition for tire SUMITOMO RUBBER IND 2014-01-22 CN disclosed
US-8546582-B2 Sulfenamide, vulcanization accelerator containing the sulfenamide for rubber, and process for producing the vulcanization accelerator OUCHI SHINKO CHEMICAL INDUSTRIAL CO., LTD. (JP) 2013-10-01 US disclosed
US-8258213-B2 Rubber composition for breaker topping SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2012-09-04 US disclosed
US-8124692-B2 Rubber composition for tire SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2012-02-28 US disclosed
US-8124692-B2 Rubber composition for tire SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2012-02-28 US disclosed
US-20100324301-A1 SULFENAMIDE, VULCANIZATION ACCELERATOR CONTAINING THE SULFENAMIDE FOR RUBBER, AND PROCESS FOR PRODUCING THE VULCANIZATION ACCELERATOR OUCHI SHINKO CHEMICAL INDUSTRIAL CO., LTD. (JP) 2010-12-23 US disclosed
CN-101878262-A Rubber composition for tire SUMITOMO RUBBER IND 2010-11-03 CN disclosed
US-20100256258-A1 RUBBER COMPOSITION FOR TIRE SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2010-10-07 US disclosed
US-20100256258-A1 RUBBER COMPOSITION FOR TIRE SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2010-10-07 US disclosed
EP-2236502-A1 SULFENAMIDE, VULCANIZATION ACCELERATOR CONTAINING THE SULFENAMIDE FOR RUBBER, AND PROCESS FOR PRODUCING THE SAME Ouchi Shinko Chemical Industrial Co., Ltd. (JP) 2010-10-06 EP disclosed
US-20100227955-A1 RUBBER COMPOSITION FOR BREAKER TOPPING SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2010-09-09 US disclosed
JP-2009155637-A RUBBER COMPOSITION FOR TIRE SUMITOMO RUBBER IND LTD 2009-07-16 JP disclosed
WO-2009072560-A1 RUBBER COMPOSITION FOR TIRE SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2009-06-11 WO disclosed
EP-0112109-B1 SULPHUR-VULCANISABLE POLYMER COMPOSITIONS POLYSAR LIMITED (CA) 1989-03-01 EP 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 (1 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-20100324301-A1 SULFENAMIDE, VULCANIZATION ACCELERATOR CONTAINING THE SULFENAMIDE FOR RUBBER, AND PROCESS FOR PRODUCING THE VULCANIZATION ACCELERATOR SULT1E1, SULT1A1, MMS19 ALDH1A1 1694/4885HSD17B10 1204/4885HPGD 1107/4885

“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.