SCHEMBL2142091

SCHEMBL2142091

C=CC[C](C=C)CCCC

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.46
ALDH1A1 P00352 3/20 0.46
CES1 P23141 2/20 0.35
CES2 O00748 1/20 0.35
HPGD P15428 1/20 0.34
FAAH O00519 1/20 0.34
ZDHHC20 Q5W0Z9 1/20 0.32
ZDHHC2 Q9UIJ5 1/20 0.32
TP53 P04637 1/20 0.32
CA1 P00915 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
SCHEMBL568648 0.93 TSHR (0.44) TSHRALDH1A1CES1CES2FAAH
SCHEMBL10493558 0.85
SCHEMBL10440474 0.85 TSHR (0.48) TSHRALDH1A1CES1CES2HPGD
SCHEMBL1533739 0.80 TSHR (0.43) TSHRALDH1A1CES1CES2FAAH
SCHEMBL9275817 0.80
SCHEMBL797999 0.77 TSHR (0.46) TSHRALDH1A1CES1CES2FAAH
SCHEMBL11125330 0.75 TSHR (0.46) TSHRALDH1A1CES1CES2FAAH
SCHEMBL16030163 0.75 TSHR (0.46) TSHRALDH1A1CES1CES2FAAH
SCHEMBL3821402 0.75 TSHR (0.43) TSHRALDH1A1CES1CES2HPGD
SCHEMBL595267 0.75 TSHR (0.43) TSHRALDH1A1CES1CES2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103702656-B Shampoo compositions SHISEIDO CO.,LTD. (JP) 2015-09-30 CN disclosed
CN-103002861-B Benefit delivery particle, process for preparing said particle, compositions comprising said particles and a method for treating substrates UNILEVER NV 2015-07-01 CN disclosed
CN-101484131-B Cosmetic hair preparation SHISEIDO CO LTD 2014-06-25 CN disclosed
CN-103702656-A Shampoo compositions SHISEIDO CO LTD 2014-04-02 CN disclosed
US-20140086864-A1 Shampoo Compostion SHISEIDO COMPANY, LTD. (JP) 2014-03-27 US disclosed
US-7994250-B2 Vinyl-urethane copolymers with intermediary linkage segments having silicon-oxygen bonds and production methods thereof KONISHI CO., LTD. (JP) 2011-08-09 US disclosed
US-7863374-B2 Self-curable water-based solid adhesive and bonding method using the self-curable water-based solid adhesive KONISHI CO., LTD. (JP) 2011-01-04 US disclosed
US-20090326151-A1 HAIR COSMETIC KONISHI CO., LTD. (JP) 2009-12-31 US disclosed
CN-101484131-A Cosmetic hair preparation SHISEIDO CO LTD (JP) 2009-07-15 CN disclosed
CN-100484986-C Vinyl-urethane copolymer and method for producing same KONISHI CO LTD (JP) 2009-05-06 CN disclosed
EP-2039347-A1 COSMETIC HAIR PREPARATION Shiseido Company, Limited (JP) 2009-03-25 EP disclosed
US-20080119607-A1 Self-curable water-based solid adhesive and bonding method using the self-curable water-based solid adhesive SHIBAHARA SYUNSUKE 2008-05-22 US disclosed
EP-1837360-A1 VINYL-URETHANE COPOLYMER AND METHOD FOR PRODUCING SAME Konishi Co., Ltd. (JP) 2007-09-26 EP disclosed
US-20070117902-A1 Vinyl-urethane copolymers and production methods thereof KONISHI CO., LTD. (JP) 2007-05-24 US disclosed
CN-1914252-A Vinyl-urethane copolymer and process for producing the same KONISHI CO LTD (JP) 2007-02-14 CN disclosed
US-7084203-B2 Self-reactive/curable water-based solid adhesive and method of bonding with the self-reactive/curable water-based solid adhesive KONISHI CO., LTD. (JP) 2006-08-01 US disclosed
US-20040132864-A1 Self-reactive/curable water-based solid adhesive and method of bonding with the self-reactive/curable water-based solid adhesive KONISHI CO., LTD. (JP) 2004-07-08 US disclosed
EP-1431366-A1 SELF−REACTIVE/CURABLE WATER−BASED SOLID ADHESIVE AND METHOD OF BONDING WITH THE SELF−REACTIVE/CURABLE WATER−BASED SOLID ADHESIVE KONISHI CO., LTD. (JP) 2004-06-23 EP disclosed
EP-0116611-A1 PROSTHESES CONTACT LENSES AND POLYMERS THEREFOR CONTACT LENSES (MANUFACTURING) LIMITED (GB) 1984-08-29 EP disclosed
WO-1984000968-A1 PROSTHESES CONTACT LENSES AND POLYMERS THEREFOR CONTACT LENS MFG LTD (GB) 1984-03-15 WO 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-20140086864-A1 Shampoo Compostion TAAR5, PHOSPHO1, SGMS2 TSHR 4602/4885ALDH1A1 1816/4885CES1 3048/4885

“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.