SCHEMBL1105238

SCHEMBL1105238

CC1=C(CC/C(C)=C/CCO)C(C)(C)CCC1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.60
ALOX5 P09917 1/20 0.60
RARB P10826 2/20 0.53
RARG P13631 2/20 0.53
RARA P10276 1/20 0.53
RXRA P19793 1/20 0.53
TRPA1 O75762 6/20 0.53
PLA2G1B P04054 1/20 0.49
PLA2G2A P14555 1/20 0.49
POLK Q9UBT6 1/20 0.49
ALDH1A1 P00352 3/20 0.48
MAPT P10636 3/20 0.48
GAA P10253 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
BLM P54132 1/20 0.48
LMNA P02545 1/20 0.40
NR1I2 O75469 1/20 0.37
USP2 O75604 1/20 0.37

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
SCHEMBL9016180 1.00 ALOX15 (0.60) ALOX15ALOX5RARBRARGRARA
SCHEMBL5595508 1.00 ALOX15 (0.60) ALOX15ALOX5RARBRARGRARA
SCHEMBL9016171 0.92 ALOX15 (0.57) ALOX15ALOX5RARBRARGRARA
SCHEMBL9016201 0.92 ALOX15 (0.57) ALOX15ALOX5RARBRARGRARA
SCHEMBL9016176 0.92 ALOX15 (0.57) ALOX15ALOX5RARBRARGRARA
SCHEMBL23587933 0.89 ALOX15 (0.64) ALOX15ALOX5RARBRARGRARA
SCHEMBL23587934 0.89 ALOX15 (0.57) ALOX15ALOX5RARBRARGRARA
SCHEMBL23587919 0.88 ALOX15 (0.56) ALOX15ALOX5RARBRARGRARA
SCHEMBL10818080 0.88 ALOX15 (0.56) ALOX15ALOX5RARBRARGRARA
SCHEMBL10818084 0.88 ALOX15 (0.56) ALOX15ALOX5RARBRARGRARA

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
EP-0403945-B1 Cycloaliphatic carbinols and their use as starting materials for the preparation of furan derivatives FIRMENICH & CIE (CH) 1996-12-18 EP claimed
US-20190023679-A1 METHOD FOR SYNTHESISING AMBROXIDE FROM AGERATINA JOCOTEPECANA UNIVERSIDAD MICHOACANA DE SAN NICOLÁS DE HIDALGO (MX) 2019-01-24 US disclosed
US-8153826-B2 Process for production of (±)-3a,6,6,9a-Tetramethyldecahydronaphtho[2,1-b]Furan-2(1H)-one KAO CORPORATION (JP) 2012-04-10 US disclosed
US-8153826-B2 Process for production of (±)-3a,6,6,9a-Tetramethyldecahydronaphtho[2,1-b]Furan-2(1H)-one KAO CORPORATION (JP) 2012-04-10 US disclosed
US-20090270639-A1 PROCESS FOR PRODUCTION OF (±)-3A,6,6,9A- TETRAMETHYLDECAHYDRONAPHTHO[2,1-B]FURAN-2(1H)-ONE KAO CORPORATION (JP) 2009-10-29 US disclosed
US-20090270639-A1 PROCESS FOR PRODUCTION OF (±)-3A,6,6,9A- TETRAMETHYLDECAHYDRONAPHTHO[2,1-B]FURAN-2(1H)-ONE KAO CORPORATION (JP) 2009-10-29 US disclosed
EP-1422279-B1 Semiconductor package with a die attach adhesive having silane functionality NAT STARCH CHEM INVEST (US) 2007-04-04 EP disclosed
US-6784025-B2 Semiconductor package with a die attach adhesive having silane functionality NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION 2004-08-31 US disclosed
EP-1422279-A1 Semiconductor package with a die attach adhesive having silane functionality National Starch and Chemical Investment Holding Corporation (US) 2004-05-26 EP disclosed
US-20040097014-A1 SEMICONDUCTOR PACKAGE WITH A DIE ATTACH ADHESIVE HAVING SILANE FUNCTIONALITY HENKEL AG & CO. KGAA (DE) 2004-05-20 US disclosed
EP-0403945-B1 Cycloaliphatic carbinols and their use as starting materials for the preparation of furan derivatives FIRMENICH & CIE (CH) 1996-12-18 EP disclosed
EP-0585828-B1 Preparation of 6-(2,6,6-trimethyl-cyclohex-1-en-tyl)-4-methyl-hex-3-enol and -4-enol GIVAUDAN ROURE INT (CH) 1995-11-02 EP disclosed
EP-0585828-B1 Preparation of 6-(2,6,6-trimethyl-cyclohex-1-en-tyl)-4-methyl-hex-3-enol and -4-enol GIVAUDAN ROURE INT (CH) 1995-11-02 EP disclosed
US-5329053-A Process for the manufacture of known odorants GIVAUDAN-ROURE CORPORATION (US) 1994-07-12 US disclosed
EP-0585828-A1 Preparation of 6-(2,6,6-trimethyl-cyclohex-1-en-tyl)-4-methyl-hex-3-enol and -4-enol GIVAUDAN-ROURE (INTERNATIONAL) S.A. (CH) 1994-03-09 EP disclosed
EP-0585828-A1 Preparation of 6-(2,6,6-trimethyl-cyclohex-1-en-tyl)-4-methyl-hex-3-enol and -4-enol GIVAUDAN-ROURE (INTERNATIONAL) S.A. (CH) 1994-03-09 EP disclosed
US-5155239-A Preparation of polycyclic ethers FIRMENICH S.A. (CH) 1992-10-13 US disclosed
US-5155238-A Acidic cyclization of polyunsaturated, acyclic alcohol or protected alcohol; stereospecific; organoleptic FIRMENICH S.A. (CH) 1992-10-13 US disclosed
US-5077417-A Acidifying, cyclizing a polyunsaturated alicyclic alcohol or protected hydroxy group FIRMENICH SA (CH) 1991-12-31 US disclosed
EP-0403945-A2 Cycloaliphatic carbinols and their use as starting materials for the preparation of furan derivatives FIRMENICH SA (CH) 1990-12-27 EP 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 (2 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-20090270639-A1 PROCESS FOR PRODUCTION OF (±)-3A,6,6,9A- TETRAMETHYLDECAHYDRONAPHTHO[2,1-B]FURAN-2(1H)-ONE COASY, FASN, CYP2C9 ALOX15 136/4885ALOX5 47/4885RARB 661/4885
US-20190023679-A1 METHOD FOR SYNTHESISING AMBROXIDE FROM AGERATINA JOCOTEPECANA MMP11, CYP4A11, TRHDE ALOX15 238/4885ALOX5 608/4885RARB 3826/4885

“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.