SCHEMBL129740

SCHEMBL129740

OCCCCC(O)COCC(O)CCCCO

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.34
USP2 O75604 1/20 0.34
THRB P10828 1/20 0.33
PTPN1 P18031 1/20 0.32
ALOX5 P09917 1/20 0.31
PSMD14 O00487 2/20 0.31
PLA2G1B P04054 2/20 0.31
MMP2 P08253 2/20 0.31
ATG4B Q9Y4P1 2/20 0.31
HSP90AA1 P07900 1/20 0.31
RAD52 P43351 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C19 P33261 1/20 0.30

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
SCHEMBL7545745 0.93 USP2 (0.44) KDM4EUSP2THRBPTPN1CYP3A4
SCHEMBL6322502 0.92 KDM4E (0.36) KDM4EUSP2THRBPTPN1CYP1A2
SCHEMBL1783854 0.91 USP2 (0.47) KDM4EUSP2THRBPTPN1ALOX5
SCHEMBL2139326 0.91 USP2 (0.47) KDM4EUSP2THRBPTPN1ALOX5
SCHEMBL14401173 0.86 USP2 (0.47) USP2THRBPTPN1ALOX5PSMD14
SCHEMBL8846615 0.86 USP2 (0.42) USP2THRBPTPN1ALOX5PSMD14
SCHEMBL7116256 0.85 USP2 (0.45) KDM4EUSP2THRBPTPN1CYP3A4
1,4-Butanediol SCHEMBL11042082 0.81 USP2 (0.50) KDM4EUSP2THRBCYP1A2CYP2C19
SCHEMBL272732 0.81 CA1 (0.55) USP2CYP3A4
SCHEMBL3893094 0.81 USP2 (0.56) KDM4EUSP2THRBPSMD14PLA2G1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1079665-C Personal cleansing compositions PROCTER & GAMBLE (US) 2002-02-27 CN claimed
US-5989536-A Personal cleansing compositions containing alkoxylated ether and cationic ammonium salt for deposition of active agent upon the skin THE PROCTER & GAMBLE COMPANY (US) 1999-11-23 US claimed
EP-0714283-B1 PERSONAL CLEANSING COMPOSITIONS PROCTER & GAMBLE (US) 1999-05-12 EP claimed
CN-1130864-A Personal cleansing compositions PROCTER & GAMBLE (US) 1996-09-11 CN claimed
EP-0714283-A1 PERSONAL CLEANSING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1996-06-05 EP claimed
WO-1995003781-A1 PERSONAL CLEANSING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1995-02-09 WO claimed
EP-1469813-B1 ADDITIVES AND PRODUCTS INCLUDING OLIGOESTERS CRODA INC (US) 2016-12-21 EP disclosed
EP-1776161-B1 COSMETIC OR DERMOPHARMACEUTICAL COMPOSITION COMPRISING AT LEAST ONE UDP GLUCURONOSYL TRANSFERASE (UGT) ENZYMES INDUCER SEDERMA S A S (FR) 2016-10-26 EP disclosed
EP-1463793-B1 MIXTURES OF QUATERNARY COMPOUNDS CRODA INC (US) 2016-10-19 EP disclosed
EP-1435978-B1 ESTERS OF AROMATIC ALKOXYLATED ALCOHOLS AND FATTY CARBOXYLIC ACIDS CRODA INC (US) 2014-09-03 EP disclosed
US-8530426-B2 Topical use of a UGT inducer-containing composition comprising a dermatologically acceptable carrier to protect and/or enhance the state of the skin/hair and prevent and/or treat imperfections of the skin; flavanoids such as chrysin stimulates isoforms; protective coatings aging/ wrinkling resistance SEDERMA SAS (FR) 2013-09-10 US disclosed
US-20130129656-A1 \"GREEN\" DIESTER AMINES AND PERSONAL CARE PRODUCTS CRODA, INC. (US) 2013-05-23 US disclosed
US-8414906-B2 Additives and products including oligoesters CRODA, INC. (US) 2013-04-09 US disclosed
WO-1997001326-A1 STABLE TOPICAL COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1997-01-16 WO disclosed
CN-1130864-A Personal cleansing compositions PROCTER & GAMBLE (US) 1996-09-11 CN disclosed
US-5534265-A INSOLUBILE POLYMER PARTICLES, GELLING AGENT, SURFACTANT, EMOLIENT THE PROCTER & GAMBLE COMPANY (US) 1996-07-09 US disclosed
EP-0714283-A1 PERSONAL CLEANSING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1996-06-05 EP disclosed
WO-1996006595-A1 PERSONAL CLEANSING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1996-03-07 WO disclosed
WO-1995003781-A1 PERSONAL CLEANSING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1995-02-09 WO disclosed
US-4250105-A REACTING DIHYDROXY-SUBSTITUTED ALIPHATIC COMPOUND AND CYANOGEN HALIDE THE DOW CHEMICAL COMPANY (US) 1981-02-10 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-20130129656-A1 \"GREEN\" DIESTER AMINES AND PERSONAL CARE PRODUCTS POLR1C, TYR, QARS1 KDM4E 2426/4885USP2 1424/4885THRB 3170/4885

“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.