SCHEMBL3942283

SCHEMBL3942283

C/C=C\c1cc(C(C)C)ccc1C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.50
PTGS1 P23219 3/20 0.48
TRPA1 O75762 1/20 0.48
CACNA1C Q13936 1/20 0.48
PTGS2 P35354 2/20 0.41
TYR P14679 4/20 0.39
RNASEH1 O60930 1/20 0.36
HTT P42858 3/20 0.34
ALDH1A1 P00352 2/20 0.34
ALOX12 P18054 2/20 0.34
GAA P10253 1/20 0.34
HIF1A Q16665 1/20 0.34
BCHE P06276 3/20 0.34
ACHE P22303 3/20 0.34
SMN1; SMN2 Q16637 3/20 0.33
ALOX5 P09917 1/20 0.33
NPC1 O15118 1/20 0.33
SCN4A P35499 1/20 0.33
RAB9A P51151 1/20 0.33
KDM4E B2RXH2 1/20 0.32

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
SCHEMBL2161558 1.00 LMNA (0.50) LMNAPTGS1TRPA1CACNA1CPTGS2
SCHEMBL1491155 1.00 LMNA (0.50) LMNAPTGS1TRPA1CACNA1CPTGS2
SCHEMBL31494654 1.00 LMNA (0.50) LMNAPTGS1TRPA1CACNA1CPTGS2
SCHEMBL29364648 1.00 LMNA (0.50) LMNAPTGS1TRPA1CACNA1CPTGS2
Acetic Acid SCHEMBL28742621 0.90 PTGS1 (0.44) LMNAPTGS1TRPA1CACNA1CPTGS2
SCHEMBL25669034 0.83 TYR (0.46) LMNAPTGS1TRPA1CACNA1CPTGS2
SCHEMBL15146335 0.82 LMNA (0.48) LMNAPTGS1TRPA1CACNA1CPTGS2
SCHEMBL19806149 0.80 LMNA (0.43) LMNAPTGS1TRPA1CACNA1CPTGS2
SCHEMBL18036277 0.80 PTGS1 (0.33) LMNAPTGS1TRPA1CACNA1CPTGS2
SCHEMBL25976888 0.79 LMNA (0.46) LMNAPTGS1TRPA1CACNA1CPTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11069856-B2 Solution for organic EL, method of producing organic EL device and organic EL device JOLED INC. (JP) 2021-07-20 US disclosed
EP-3554275-A1 MODIFYING OR ENHANCING A FLAVOR OF FOOD AND BEVERAGE PRODUCTS Tate & Lyle Ingredients Americas LLC (US) 2019-10-23 EP disclosed
US-20190313680-A1 MODIFYING OR ENHANCING A FLAVOR OF FOOD AND BEVERAGE PRODUCTS TATE & LYLE INGREDIENTS AMERICAS LLC (US) 2019-10-17 US disclosed
US-10006151-B2 Polyurethane fiber TORAY OPELONTEX CO., LTD. (JP) 2018-06-26 US disclosed
WO-2018109464-A1 MODIFYING OR ENHANCING A FLAVOR OF FOOD AND BEVERAGE PRODUCTS TATE & LYLE INGREDIENTS AMERICAS LLC (US) 2018-06-21 WO disclosed
US-20180069178-A1 SOLUTION FOR ORGANIC EL, METHOD OF PRODUCING ORGANIC EL DEVICE AND ORGANIC EL DEVICE MAGNOLIA BLUE CORPORATION (JP) 2018-03-08 US disclosed
EP-2947185-B1 POLYURETHANE FIBER AND ITS USE TORAY OPELONTEX CO LTD (JP) 2018-02-28 EP disclosed
US-9358191-B2 Deodorant composition TAKASAGO INTERNATIONAL CORPORATION (JP) 2016-06-07 US disclosed
US-20160002827-A1 POLYURETHANE FIBER TORAY OPELONTEX CO., LTD. (JP) 2016-01-07 US disclosed
EP-2947185-A1 POLYURETHANE FIBER Toray Opelontex Co., Ltd (JP) 2015-11-25 EP disclosed
EP-2049729-A2 FABRIC CARE COMPOSITIONS INVISTA Technologies S.à.r.l. (CH) 2009-04-22 EP disclosed
US-20090087401-A1 DEODORANT COMPOSITION TAKASAGO INTERNATIONAL CORPORATION (JP) 2009-04-02 US disclosed
CN-101400850-A Nonwoven polymer compositions and methods INVISTA TECH SARL (CH) 2009-04-01 CN disclosed
US-20080085251-A1 even at a neutral to weakly acidic pH; a lactone or lactam having a mercapto group; with thioglycolic acid, thiolactic acid, cysteine, acetylcysteine, cysteamine, acylcysteamine; RESONAC CORPORATION (JP) 2008-04-10 US disclosed
CN-100376292-C Deodorant composition TAKASAGO PERFUMERY CO LTD (JP) 2008-03-26 CN disclosed
WO-2008022066-A2 FABRIC CARE COMPOSITIONS INVISTA TECHNOLOGIES S.A.R.L. (CH) 2008-02-21 WO disclosed
US-20060165622-A1 Deodorant composition TAKASAGO INTERNATIONAL CORPORATION (JP) 2006-07-27 US disclosed
CN-1732019-A Deodorant composition TAKASAGO PERFUMERY CO LTD (JP) 2006-02-08 CN disclosed
EP-1561476-A1 DEODORANT COMPOSITION Takasago International Corporation (JP) 2005-08-10 EP disclosed
US-4219570-A Insect repellents and a method of repelling insects AJINOMOTO COMPANY, INCORPORATED (JP) 1980-08-26 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 (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-20080085251-A1 even at a neutral to weakly acidic pH; a lactone or lactam having a mercapto group; with thioglycolic acid, thiolactic acid, cysteine, acetylcysteine, cysteamine, acylcysteamine; TST, CYSLTR1, CYSLTR2 LMNA 4594/4885PTGS1 666/4885TRPA1 18/4885

“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.