SCHEMBL4448966

SCHEMBL4448966

COCCC(C)CCC=C(C)C

nearest known ligand 0.65

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.65
ALDH1A1 P00352 1/20 0.61
NFE2L2 Q16236 1/20 0.46
USP2 O75604 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
TSHR P16473 1/20 0.41
GGPS1 O95749 2/20 0.38
FDPS P14324 2/20 0.38
EPHX2 P34913 1/20 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
SCHEMBL14581768 1.00 ALOX15 (0.65) ALOX15ALDH1A1NFE2L2USP2TDP1
SCHEMBL17955374 1.00 ALOX15 (0.65) ALOX15ALDH1A1NFE2L2USP2TDP1
SCHEMBL7935236 0.89 ALOX15 (0.54) ALOX15ALDH1A1
SCHEMBL7935232 0.89 ALOX15 (0.54) ALOX15ALDH1A1
Citronellyl Acetate SCHEMBL10961285 0.88 ALOX15 (0.87) ALOX15ALDH1A1NFE2L2USP2TDP1
SCHEMBL3753013 0.86 ALOX15 (0.54) ALOX15ALDH1A1NFE2L2USP2TDP1
SCHEMBL8397532 0.85 ALOX15 (0.67) ALOX15ALDH1A1NFE2L2USP2TDP1
SCHEMBL8059226 0.85 ALOX15 (0.67) ALOX15ALDH1A1NFE2L2USP2TDP1
SCHEMBL27200268 0.83 ALOX15 (0.65) ALOX15ALDH1A1NFE2L2USP2TDP1
SCHEMBL4406232 0.82 ALOX15 (0.59) ALOX15ALDH1A1NFE2L2USP2TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7572938-B2 Precursors for ketones and aldehydes GIVAUDAN SA (CH) 2009-08-11 US claimed
CN-87103789-A Through improving the polydicyclopentadiene of smell 1988-12-14 CN claimed
US-4731395-A Polydicyclopentadiene having improved odor HERCULES INCORPORATED (US) 1988-03-15 US claimed
EP-0249032-A1 Polydicyclopentadiene having improved odor HERCULES INCORPORATED (US) 1987-12-16 EP claimed
US-20240016144-A1 CLEAR, STABLE, WATER-BASED MICROEMULSION FORMULATIONS, COMPOSITIONS AND METHODS FOR PEST CONTROL WILMINGTON TRUST, NATIONAL ASSOCIATION, AS ADMINISTRATIVE AGENT 2024-01-18 US disclosed
WO-2022119738-A1 CLEAR, STABLE, WATER-BASED MICROEMULSION FORMULATIONS, COMPOSITIONS AND METHODS FOR PEST CONTROL TYRATECH, INC. (US) 2022-06-09 WO disclosed
WO-2019037862-A1 ORGANOSULPHUR COMPOUNDS AS ODORANTS AND FLAVOURINGS SYMRISE AG (DE) 2019-02-28 WO disclosed
WO-2019037862-A1 ORGANOSULPHUR COMPOUNDS AS ODORANTS AND FLAVOURINGS SYMRISE AG (DE) 2019-02-28 WO disclosed
EP-3087111-B1 PROCESSES TO FORM ETHYLENE-BASED POLYMERS USING ASYMMETRICAL POLYENES DOW GLOBAL TECHNOLOGIES LLC (US) 2019-01-30 EP disclosed
EP-3087112-B1 PROCESSES TO IMPROVE REACTOR STABILITY FOR THE PREPARATION OF ETHYLENE-BASED POLYMERS USING ASYMMETRICAL POLYENES DOW GLOBAL TECHNOLOGIES LLC (US) 2019-01-30 EP disclosed
US-9796650-B2 Inhibitor combination for lithium salt-catalyzed transesterification process and method for removing lithium salt DOW GLOBAL TECHNOLOGIES LLC (US) 2017-10-24 US disclosed
US-9718906-B2 Processes to form ethylene-based polymers using asymmetrical polyenes DOW GLOBAL TECHNOLOGIES LLC (US) 2017-08-01 US disclosed
US-4250194-A Flavoring with geranyl butyl ether INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1981-02-10 US disclosed
US-4246287-A LEMON FLAVOR INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1981-01-20 US disclosed
US-4223046-A ROOT BEER BEVERAGE INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1980-09-16 US disclosed
US-4173543-A COPPER OR ZINC CYSTINE INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1979-11-06 US disclosed
US-4173711-A ORGANOLEPTIC INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1979-11-06 US disclosed
US-4169073-A 3(2-Chloroalkyloxy)2 (10)-pinene perfumes compositions INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1979-09-25 US disclosed
US-4163068-A Flavoring with terpenyl ethers INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1979-07-31 US disclosed
US-4131687-A Flavoring with terpenyl ethers INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1978-12-26 US disclosed