SCHEMBL1105231

SCHEMBL1105231

CC1(C)CCCC2(C)C1CCC(C)(O)C2CCO

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.61
CYP3A4 P08684 2/20 0.61
CYP2C9 P11712 2/20 0.61
TSHR P16473 2/20 0.61
CYP2C19 P33261 2/20 0.61
MEN1 O00255 1/20 0.61
MAPT P10636 1/20 0.61
KMT2A Q03164 1/20 0.61
TRPV1 Q8NER1 1/20 0.54
UGT2B7 P16662 7/20 0.43
TRPA1 O75762 2/20 0.41
NR1H4 Q96RI1 2/20 0.38
PLA2G2A P14555 1/20 0.36
PTPN1 P18031 1/20 0.35
IDO1 P14902 1/20 0.35

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
SCHEMBL9880617 1.00 ALDH1A1 (0.61) ALDH1A1CYP3A4CYP2C9TSHRCYP2C19
SCHEMBL31139943 1.00 ALDH1A1 (0.61) ALDH1A1CYP3A4CYP2C9TSHRCYP2C19
SCHEMBL8611875 1.00 ALDH1A1 (0.61) ALDH1A1CYP3A4CYP2C9TSHRCYP2C19
SCHEMBL3112008 1.00 ALDH1A1 (0.61) ALDH1A1CYP3A4CYP2C9TSHRCYP2C19
SCHEMBL3112011 1.00 ALDH1A1 (0.61) ALDH1A1CYP3A4CYP2C9TSHRCYP2C19
SCHEMBL19958385 0.87 ALDH1A1 (0.61) ALDH1A1CYP3A4CYP2C9TSHRCYP2C19
SCHEMBL27017541 0.87 ALDH1A1 (0.61) ALDH1A1CYP3A4CYP2C9TSHRCYP2C19
SCHEMBL385019 0.87 ALDH1A1 (0.57) ALDH1A1CYP3A4CYP2C9TSHRCYP2C19
SCHEMBL10101191 0.87 ALDH1A1 (0.57) ALDH1A1CYP3A4CYP2C9TSHRCYP2C19
SCHEMBL9880760 0.87 ALDH1A1 (0.57) ALDH1A1CYP3A4CYP2C9TSHRCYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2471939-B1 Method for producing 1-(2-hydroxyethyl) 2,5,5,8a-tetramethyldecahydronaphthalene-2-ol by microbial fermentation KAO CORP (JP) 2020-11-04 EP claimed
EP-1997879-B1 MICROORGANISM AND METHOD FOR PRODUCING DECAHYDRO-2-HYDROXY-2,5,5,8a-TETRAMETHYLNAPHTHALENEETHANOL AND/OR SCLAREOLIDE (DECAHYDRO-3a,6,6,9a- TETRAMETHYLNAPHTHO[2,1-b]FURAN-2(1H)-ONE) USING THE SAME KAO CORP (JP) 2015-07-01 EP claimed
US-8822186-B2 Method for producing microbial fermentation product KAO CORPORATION (JP) 2014-09-02 US claimed
EP-2400025-B1 Process for producing microbial fermentation product KAO CORP (JP) 2013-11-20 EP claimed
EP-2123765-B1 Method for production of microbial fermentation product KAO CORP (JP) 2013-07-31 EP claimed
US-8293518-B2 Microorganism and method for producing dodecahydro-3a,6,6,9a-tetramethylnaphtho[2,1-b]furan intermediate using the novel microorganism KAO CORPORATION (JP) 2012-10-23 US claimed
US-8252565-B2 Method for production of microbial fermentation product KAO CORPORATION (JP) 2012-08-28 US claimed
EP-2471939-A1 METHOD FOR PRODUCING MICROBIAL FERMENTATION PRODUCT Kao Corporation (JP) 2012-07-04 EP claimed
US-20120135484-A1 METHOD FOR PRODUCING MICROBIAL FERMENTATION PRODUCT KAO CORPORATION (JP) 2012-05-31 US claimed
US-20120107917-A1 Novel Microorganism and Method for Producing Dodecahydro-3a,6,6,9a-Tetramethylnaphtho[2,1-b]Furan Intermediate Using the Novel Microorganism KAO CORPORATION (JP) 2012-05-03 US claimed
EP-0550889-A1 Process for producing L-Ambrox KURARAY CO., LTD. (JP) 1993-07-14 EP claimed
US-5136112-A PROCESS FOR PREPARING 2-HYDROXY-2 5, 5, 9-TETRAMETHYLDECALYL ETHANOL KAO CORPORATION (JP) 1992-08-04 US claimed
EP-0471281-A1 Process for preparing 2-hydroxy-2, 5, 5, 9-tetramethyldecalyl ethanol KAO CORPORATION (JP) 1992-02-19 EP claimed
EP-0170955-B1 Process for the preparation of (+/-)-3a-6,6,9a-tetramethylperhydronaphto[2,1-b]furan FIRMENICH SA (CH) 1992-01-08 EP claimed
US-4613710-A CYCLIZATION OF 1B-(2-HYDROXYETHYL)-PERHYDRO-2,5,5,82B-TETRAMETHYL-2B-TRANS-NAPHTHALENOL FIRMENICH SA (CH) 1986-09-23 US claimed
EP-0170955-A2 Process for the preparation of (+/-)-3a-6,6,9a-tetramethylperhydronaphto[2,1-b]furan FIRMENICH SA (CH) 1986-02-12 EP claimed
EP-0165458-A2 (+)-Ambrox, process for production thereof and use thereof T. HASEGAWA COMPANY, LTD. (JP) 1985-12-27 EP claimed
US-4207905-A Isobutyl substituted heterocyclic compounds for augmenting or enhancing the organoleptic properties of smoking tobaccos and smoking tobacco articles INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1980-06-17 US claimed
US-4170236-A TRIISOBUTYL TRIOXANE INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1979-10-09 US claimed
US-4135520-A CIGARETTES INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1979-01-23 US claimed