SCHEMBL18825922

SCHEMBL18825922

CC(C)=CCCB(O)OC(C)(C)C(C)(C)O

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.36

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
SCHEMBL10324728 0.82 ALOX15 (0.31) ALOX15
SCHEMBL290668 0.73 ALDH1A1 (0.31)
SCHEMBL5953079 0.71 ANPEP (0.41)
SCHEMBL1300947 0.69
SCHEMBL661999 0.69 ANPEP (0.34)
SCHEMBL9903702 0.69
SCHEMBL17891917 0.68 ANPEP (0.33)
SCHEMBL10624549 0.67
SCHEMBL18074209 0.67
SCHEMBL5838629 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108473911-B Formylthiophenes and their use in flavour and fragrance compositions 国际香料和香精公司 2021-10-29 CN disclosed
EP-3371291-B1 FORMYLTHIOPHENES AND THEIR USE IN FLAVOR AND FRAGRANCE COMPOSITIONS INT FLAVORS & FRAGRANCES INC (US) 2020-02-19 EP disclosed
EP-3371291-A1 FORMYLTHIOPHENES AND THEIR USE IN FLAVOR AND FRAGRANCE COMPOSITIONS International Flavors & Fragrances Inc. (US) 2018-09-12 EP disclosed
WO-2017079368-A1 FORMYLTHIOPHENES AND THEIR USE IN FLAVOR AND FRAGRANCE COMPOSITIONS INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2017-05-11 WO disclosed