3,7-Epoxycaryophyllan-6-Ol

3,7-Epoxycaryophyllan-6-Ol

SCHEMBL24176356

CC1(C)C[C@H]2[C@H]1CC[C@@]1(C)O[C@]2(C)CC[C@H]1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 6/20 1.00
ALDH1A1 P00352 2/20 0.41
FTH1 P02794 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
PTPN1 P18031 1/20 0.32
ATP1A1 P05023 1/20 0.32
ATP1B1 P05026 1/20 0.32
ATP1A3 P13637 1/20 0.32
ATP1B2 P14415 1/20 0.32
ATP1A2 P50993 1/20 0.32
ATP1B3 P54709 1/20 0.32
FXYD2 P54710 1/20 0.32
ATP1A4 Q13733 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32

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
3,7-Epoxycaryophyllan-6-Ol SCHEMBL24176170 1.00 CYP3A4 (1.00) CYP3A4ALDH1A1FTH1CYP2C9CYP2C19
SCHEMBL4274557 0.73 CYP3A4 (0.57) CYP3A4ALDH1A1
SCHEMBL4192842 0.70 CYP3A4 (0.54) CYP3A4ALDH1A1FTH1CYP2C9CYP2C19
SCHEMBL22417663 0.68 CYP3A4 (0.57) CYP3A4ALDH1A1PTPN1
SCHEMBL24199634 0.66 CYP3A4 (0.49) CYP3A4
SCHEMBL24176299 0.66 ALDH1A1 (0.53) CYP3A4ALDH1A1
SCHEMBL29801778 0.66 ALDH1A1 (0.53) CYP3A4ALDH1A1
SCHEMBL15944367 0.66 ALDH1A1 (0.53) CYP3A4ALDH1A1
SCHEMBL9832207 0.63 CYP3A4 (0.46) CYP3A4PTPN1ATP1A1ATP1B1ATP1A3
SCHEMBL10938972 0.63 LMNA (0.50) CYP3A4CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113573592-B Coated mouth feel enhancer 味之素株式会社 2025-04-18 CN disclosed
CN-117562239-A Coated mouth feel enhancer 味之素株式会社 2024-02-20 CN disclosed
US-20220000157-A1 MOUTH-COATING FEEL ENHANCER AJINOMOTO CO., INC. (JP) 2022-01-06 US disclosed