SCHEMBL4399345

SCHEMBL4399345

CCC(C)(C)c1ccc(C)cc1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.46
ALDH1A1 P00352 4/20 0.44
MAPT P10636 3/20 0.44
POLB P06746 1/20 0.44
TP53 P04637 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
LMNA P02545 3/20 0.39
CHRM1 P11229 1/20 0.39
SLC6A2 P23975 1/20 0.39
ADRA1A P35348 1/20 0.39
HTR2B P41595 1/20 0.39
ESR1 P03372 2/20 0.38
AR P10275 1/20 0.38
ESR2 Q92731 1/20 0.38
ALOX15 P16050 3/20 0.38
KDM4E B2RXH2 2/20 0.38
CYP1A2 P05177 1/20 0.38
ATP2A2 P16615 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ATP2A3 Q93084 1/20 0.38

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
SCHEMBL30893091 1.00 TRPA1 (0.46) TRPA1ALDH1A1MAPTPOLBTP53
Potassium SCHEMBL29478014 0.98 TRPA1 (0.45) TRPA1ALDH1A1MAPTPOLBTP53
SCHEMBL29477977 0.98 TRPA1 (0.45) TRPA1ALDH1A1MAPTPOLBTP53
SCHEMBL5050588 0.91 ALDH1A1 (0.48) TRPA1ALDH1A1MAPTPOLBTP53
SCHEMBL30893101 0.85 CNR1 (0.48) TRPA1ALDH1A1MAPTPOLBTP53
SCHEMBL7597386 0.84 TRPA1 (0.46) TRPA1ALDH1A1MAPTPOLBTP53
SCHEMBL30893085 0.84 TRPA1 (0.46) TRPA1ALDH1A1MAPTPOLBTP53
SCHEMBL30135130 0.84 TRPA1 (0.46) TRPA1ALDH1A1MAPTPOLBTP53
SCHEMBL29477964 0.83 CNR1 (0.47) TRPA1ALDH1A1MAPTPOLBTP53
Potassium SCHEMBL29478013 0.83 CNR1 (0.47) TRPA1ALDH1A1MAPTPOLBTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108570018-B Amide compound and preparation method and application thereof 上海晓明检测技术服务有限公司 2022-05-13 CN disclosed
CN-110734411-A pharmaceutical composition containing amide compounds and application thereof 上海泰禾国际贸易有限公司 2020-01-31 CN disclosed
CN-108570018-A Amide compound and preparation method and application thereof 上海泰禾国际贸易有限公司 2018-09-25 CN disclosed
US-20160137770-A1 COMPOUND CONTAINING PHENOLIC HYDROXYL GROUP, PHENOLIC RESIN, CURABLE COMPOSITION, CURED PRODUCT THEREOF, SEMICONDUCTOR SEALING MATERIAL, AND PRINTED CIRCUIT BOARD DIC CORPORATION (JP) 2016-05-19 US disclosed
US-20160137771-A1 COMPOUND CONTAINING PHENOLIC HYDROXYL GROUP, PHENOLIC RESIN, CURABLE COMPOSITION, CURED PRODUCT THEREOF, SEMICONDUCTOR SEALING MATERIAL, AND PRINTED CIRCUIT BOARD DIC CORPORATION (JP) 2016-05-19 US disclosed
US-8232039-B2 Polymer and resist composition comprising the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-07-31 US disclosed
US-8173352-B2 Resist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-05-08 US disclosed
US-20100151380-A1 RESIST COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-17 US disclosed
US-20100136481-A1 RESIST COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-03 US disclosed
US-20100124719-A1 Polymer and Resist Composition Comprising the Same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-05-20 US disclosed
US-20100081085-A1 Polymer and Resist Composition Comprising the Same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-04-01 US disclosed
CN-1262586-C Polymer electrolyte composition and fuel cell SUMITOMO CHEMICAL CO (JP) 2006-07-05 CN disclosed
CN-1405217-A Polymer electrolyte composition and fuel cell SUMITOMO CHEMICAL CO (JP) 2003-03-26 CN disclosed
EP-0459942-B1 Inks CIBA GEIGY AG (CH) 1995-02-22 EP disclosed
US-5261953-A CONTAINING WATER SOLUBLE STABILIZER TO IMPROVE COLORFASTNESS CIBA-GEIGY CORPORATION (US) 1993-11-16 US disclosed
US-5089050-A Phenol derivatives CIBA-GEIGY CORPORATION (US) 1992-02-18 US disclosed
EP-0459942-A1 Inks CIBA-GEIGY AG (CH) 1991-12-04 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-20160137770-A1 COMPOUND CONTAINING PHENOLIC HYDROXYL GROUP, PHENOLIC RESIN, CURABLE COMPOSITION, CURED PRODUCT THEREOF, SEMICONDUCTOR SEALING MATERIAL, AND PRINTED CIRCUIT BOARD ASH2L, SEM1, KDM1A TRPA1 214/4885ALDH1A1 119/4885MAPT 3256/4885

“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.