SCHEMBL203062

SCHEMBL203062

C=CCC1(CCC(=O)O)CCCCC1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
USP2 O75604 1/20 0.40
LMNA P02545 1/20 0.40
CYP1A2 P05177 1/20 0.40
TSHR P16473 1/20 0.40
BLM P54132 1/20 0.40
CACNA2D1 P54289 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
POLB P06746 1/20 0.37
CYP2C19 P33261 1/20 0.34
ABCC4 O15439 1/20 0.34
MAPT P10636 1/20 0.34
PTGS1 P23219 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
SCHEMBL3271482 0.89 ABCC4 (0.40) ALDH1A1USP2LMNACYP1A2TSHR
SCHEMBL225199 0.81 ALDH1A1 (0.57) ALDH1A1USP2LMNACYP1A2TSHR
SCHEMBL30016277 0.80 CYP2C19 (0.41) ALDH1A1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL15538586 0.80 LMNA (0.46) ALDH1A1USP2LMNACYP1A2TSHR
SCHEMBL14390606 0.79 ALDH1A1 (0.53) ALDH1A1USP2LMNACYP1A2TSHR
SCHEMBL9013770 0.77 KDM4E (0.37) ALDH1A1LMNACYP1A2TSHRMEN1
SCHEMBL34475704 0.76 MEN1 (0.31) ALDH1A1MEN1KMT2APOLB
SCHEMBL30569789 0.75 CYP2C19 (0.48) ALDH1A1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL3961575 0.75 POLB (0.33) ALDH1A1USP2LMNACYP1A2TSHR
SCHEMBL3960623 0.75 POLB (0.33) ALDH1A1USP2LMNACYP1A2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3052551-B1 BENEFIT AGENT CONTAINING DELIVERY PARTICLE ENCAPSYS LLC (US) 2021-12-01 EP claimed
US-10920170-B2 Fragrance mixtures containing tricyclo[5.2.1.0]-decane-8-ethyl ether SYMRISE AG (DE) 2021-02-16 US claimed
US-10876081-B2 Method for the production of scent capsules with improved surfactant stability SYMRISE AG (DE) 2020-12-29 US claimed
EP-3423028-B1 METHOD FOR THE PRODUCTION OF ENCAPSULATED FRAGRANCE WITH IMPROVED STABILITY AGAINST DETERGENTS SYMRISE AG (DE) 2020-04-08 EP claimed
US-20200063063-A1 FRAGRANCE MIXTURES CONTAINING TRICYCLO[5.2.1.0]-DECANE-8-ETHYL ETHER SYMRISE AG (DE) 2020-02-27 US claimed
EP-2160176-B1 BENEFIT AGENT CONTAINING DELIVERY PARTICLE PROCTER & GAMBLE (US) 2017-07-26 EP claimed
US-9340751-B2 Use of specific compounds for modifying odors SYMRISE AG (DE) 2016-05-17 US claimed
EP-2174645-B1 Materials containing aromas incorporating cetyl nonanoate and/or stearyl nonanoate SYMRISE AG (DE) 2015-07-29 EP claimed
US-20150182656-A1 Perfume Compositions GIVAUDAN S.A. (CH) 2015-07-02 US claimed
US-8999913-B2 Fragrance mixtures containing cyclopent-2-enyl ethyl acetate SYMRISE AG (DE) 2015-04-07 US claimed
EP-1360269-B1 AUTOMATIC DISHWASHING COMPOSITIONS COMPRISING DIACYL PEROXIDE BLEACH AND BLOOMING PERFUME PROCTER & GAMBLE (US) 2005-08-03 EP claimed
EP-1282368-B1 AMBIENT STABLE BEVERAGE UNILEVER PLC (GB) 2005-07-27 EP claimed
EP-0991327-B1 MICROORGANISM REDUCTION METHODS AND COMPOSITIONS FOR FOOD CLEANING PROCTER & GAMBLE (US) 2004-12-01 EP claimed
US-20030104969-A1 Laundry system having unitized dosing PROCTER & GAMBLE COMPANY,THE 2003-06-05 US claimed
EP-0787176-B1 FABRIC SOFTENER COMPOSITIONS WITH REDUCED ENVIRONMENTAL IMPACT PROCTER & GAMBLE (US) 2003-05-07 EP claimed
EP-1297101-A2 LAUNDRY SYSTEM HAVING UNITIZED DOSING THE PROCTER & GAMBLE COMPANY (US) 2003-04-02 EP claimed
EP-1280882-A1 HIGHLY CONCENTRATED FABRIC SOFTENER COMPOSITIONS AND ARTICLES CONTAINING SUCH COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2003-02-05 EP claimed
WO-2001085892-A1 HIGHLY CONCENTRATED FABRIC SOFTENER COMPOSITIONS AND ARTICLES CONTAINING SUCH COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2001-11-15 WO claimed
WO-2001085888-A2 LAUNDRY SYSTEM HAVING UNITIZED DOSING THE PROCTER & GAMBLE COMPANY (US) 2001-11-15 WO claimed
US-5445747-A Containing fabric softener, perfume selected to cover odors THE PROCTER & GAMBLE COMPANY (US) 1995-08-29 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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-10920170-B2 Fragrance mixtures containing tricyclo[5.2.1.0]-decane-8-ethyl ether CCT8, F8, TRPM8 ALDH1A1 370/4885USP2 3550/4885LMNA 3294/4885
US-20200063063-A1 FRAGRANCE MIXTURES CONTAINING TRICYCLO[5.2.1.0]-DECANE-8-ETHYL ETHER CCT8, F8, TRPM8 ALDH1A1 370/4885USP2 3550/4885LMNA 3294/4885
US-10876081-B2 Method for the production of scent capsules with improved surfactant stability SMOX, LIPA, SGMS2 ALDH1A1 804/4885USP2 760/4885LMNA 4378/4885

“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.