SCHEMBL17633428

SCHEMBL17633428

CCCCCCC1C(C)CCCC1(C)C

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.36
ALDH1A1 P00352 1/20 0.34
UGT2B7 P16662 2/20 0.34
CYP1A2 P05177 3/20 0.31
NOS1 P29475 3/20 0.31
NOS2 P35228 3/20 0.31
NOS3 P29474 2/20 0.31
CETP P11597 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
SCHEMBL23086227 0.98 UGT2B7 (0.35) EPHX1ALDH1A1UGT2B7CYP1A2NOS1
SCHEMBL3661700 0.93 CYP1A2 (0.38) UGT2B7CYP1A2
SCHEMBL10987091 0.89 EPHX1 (0.38) EPHX1ALDH1A1CYP1A2NOS1NOS2
Hexane SCHEMBL5010365 0.84 DNM1 (0.39)
Hexane SCHEMBL16457845 0.82 UGT2B7 (0.32) UGT2B7
SCHEMBL6143123 0.81 PRKD3 (0.35)
SCHEMBL7939563 0.80 UGT2B7 (0.49) UGT2B7CETP
SCHEMBL4771052 0.80 PTGER2 (0.35) ALDH1A1
Propanol SCHEMBL1942397 0.79 UGT2B7 (0.36) UGT2B7CETP
SCHEMBL7933164 0.78 TBXA2R (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3672692-A2 BLENDS CONTAINING ENANTIOMERICALLY PURE AMBROCENIDE® Symrise AG (DE) 2020-07-01 EP claimed
US-20250032375-A1 SOLVENT MIXTURES COMPRISING 1,3-BUTYLENE GLYCOL AND TRIETHYL-CITRATE GIVAUDAN SA (CH) 2025-01-30 US disclosed
US-20220177813-A1 TREATMENT COMPOSITIONS WITH PRO-FRAGRANCE SILICONE POLYMERS THAT COMPRISE HETEROCYCLIC MOIETIES THE PROCTER & GAMBLE COMPANY 2022-06-09 US disclosed
US-11334694-B2 Personal care compositions comprising malodor reduction compositions THE PROCTER & GAMBLE COMPANY (US) 2022-05-17 US disclosed
US-11334695-B2 Antiperspirant and deodorant compositions comprising malodor reduction compositions THE PROCTER & GAMBLE COMPANY (US) 2022-05-17 US disclosed
EP-3986995-A1 1-ALKOXYETHYL-4-ISOBUTYL-BENZENE AS AROMA INGREDIENTS BASF SE (DE) 2022-04-27 EP disclosed
WO-2020260165-A1 1-ALKOXYETHYL-4-ISOBUTYL-BENZENE AS AROMA INGREDIENTS BASF SE (DE) 2020-12-30 WO disclosed
CN-105264057-B Spice composition 花王株式会社 2019-04-05 CN disclosed
EP-3197424-A1 FRESHENING COMPOSITIONS AND DEVICES COMPRISING SAME THE PROCTER & GAMBLE COMPANY (US) 2017-08-02 EP disclosed
WO-2017070132-A1 ARRAY OF FABRIC TREATMENT PRODUCTS THE PROCTER & GAMBLE COMPANY (US) 2017-04-27 WO disclosed
WO-2016049398-A1 FRESHENING COMPOSITIONS AND DEVICES COMPRISING SAME THE PROCTER & GAMBLE COMPANY (US) 2016-03-31 WO disclosed