SCHEMBL4621624

SCHEMBL4621624

CC1=C(C)C2(C)CC(C1)C2

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL1967206 0.70
SCHEMBL9126926 0.70 GRIN2D (0.32)
SCHEMBL19169044 0.62
SCHEMBL17243999 0.60
SCHEMBL6427879 0.60 ALOX15 (0.33)
SCHEMBL8158694 0.60 ALOX15 (0.33)
SCHEMBL12832397 0.60 ALOX15 (0.33)
SCHEMBL6129666 0.58
SCHEMBL18695801 0.56
SCHEMBL22397284 0.55

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119584860-A Comprising biodegradable microcapsule composition 奇华顿股份有限公司 2025-03-07 CN disclosed
US-12016963-B2 Freshening compositions with alkoxylated phenols THE PROCTER & GAMBLE COMPANY (US) 2024-06-25 US disclosed
US-11946018-B2 Freshening compositions with ethoxylated/propoxylated aromatics THE PROCTER & GAMBLE COMPANY (US) 2024-04-02 US disclosed
CN-109562032-B Mixture comprising at least dihydro-5-pentyl-2 (3H) -furanone and 2, 4-dimethyl-4-phenyltetrahydrofuran and use thereof for masking off-flavours 伊碧申香料有限公司 2023-03-07 CN disclosed
US-11326126-B2 High performing, high impact bloom accord INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2022-05-10 US disclosed
US-20200353113-A1 FRESHENING COMPOSITIONS WITH ALKOXYLATED PHENOLS THE PROCTER & GAMBLE COMPANY 2020-11-12 US disclosed
US-20200353114-A1 FRESHENING COMPOSITIONS WITH ALKOXYLATED AROMATICS THE PROCTER & GAMBLE COMPANY 2020-11-12 US disclosed
US-20200299612-A1 HIGH PERFORMING, HIGH IMPACT BLOOM ACCORD INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2020-09-24 US disclosed
US-7452555-B2 Cocrystallization S.S.C.I., INC. (US) 2008-11-18 US disclosed