SCHEMBL158458

SCHEMBL158458

CC(C)C1CCC(CO)CC1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
APLNR P35414 1/20 0.35
ESR1 P03372 6/20 0.34
ESR2 Q92731 6/20 0.34
CYP3A4 P08684 2/20 0.34
CYP2C9 P11712 2/20 0.34
SHBG P04278 1/20 0.31
IDO1 P14902 1/20 0.31
TDO2 P48775 1/20 0.31
CYP2D6 P10635 1/20 0.31
ROCK2 O75116 1/20 0.30
ROCK1 Q13464 1/20 0.30

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
SCHEMBL225662 1.00 APLNR (0.35) APLNRESR1ESR2CYP3A4CYP2C9
SCHEMBL2294170 1.00 APLNR (0.35) APLNRESR1ESR2CYP3A4CYP2C9
SCHEMBL17219538 0.93 ESR1 (0.31) APLNRESR1ESR2CYP3A4CYP2C9
SCHEMBL12418400 0.85 OPRM1 (0.34) APLNR
SCHEMBL13313072 0.85 OPRM1 (0.34) APLNR
SCHEMBL25009658 0.85 OPRM1 (0.34) APLNR
SCHEMBL12418401 0.85 OPRM1 (0.34) APLNR
SCHEMBL10094034 0.85 OPRM1 (0.34) APLNR
SCHEMBL12418402 0.85 OPRM1 (0.34) APLNR
SCHEMBL30148749 0.84

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

Appears in 2602 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4711010-A2 PRO-PERFUME COMPOSITIONS Firmenich SA (CH) 2026-03-18 EP claimed
EP-4704791-A1 ETHANOL-FREE FRAGRANCE MICROEMULSION Coty Inc. (US) 2026-03-11 EP claimed
US-RE50800-E1 Pro-fragrance compounds FIRMENICH SA (CH) 2026-02-17 US claimed
US-12509482-B2 3′-ketoglycoside compound for the slow release of a volatile alcohol GLYCOSCIENCE, S.L. (ES) 2025-12-30 US claimed
US-20250325463-A1 COMPOSITIONS (III) SYMRISE AG (DE) 2025-10-23 US claimed
EP-4608360-A1 ANTI-DANDRUFF COMPOSITIONS Firmenich SA (CH) 2025-09-03 EP claimed
EP-4602141-A1 A FRAGRANCE MIXTURE (VI) Symrise AG (DE) 2025-08-20 EP claimed
EP-4549419-A1 PREPARATION OF CYCLOALIPHATIC OR HETEROCYCLOALIPHATIC COMPOUNDS BY HYDROGENATION OF AROMATIC OR HETEROAROMATIC COMPOUNDS USING HYDROGEN WITH LOW DEUTERIUM CONTENT BASF SE (DE) 2025-05-07 EP claimed
EP-4532646-A1 A FRAGRANCE MIXTURE (V) Symrise AG (DE) 2025-04-09 EP claimed
WO-2025068206-A1 PERFUME COMPOSITIONS GIVAUDAN SA (CH) 2025-04-03 WO claimed
WO-1998058899-A1 FRAGRANCE PRECURSOR COMPOUNDS GIVAUDAN-ROURE (INTERNATIONAL) S.A. (CH) 1998-12-30 WO claimed
EP-0878497-A2 Fragrance precursor compounds GIVAUDAN-ROURE (INTERNATIONAL) S.A. (CH) 1998-11-18 EP claimed
WO-1998047996-A1 LAUNDRY DETERGENT COMPOSITIONS COMPRISING FRAGRANCE PRO-ACCORDS THE PROCTER & GAMBLE COMPANY (US) 1998-10-29 WO claimed
WO-1998007405-A1 FRAGRANCE DELIVERY SYSTEMS THE PROCTER & GAMBLE COMPANY (US) 1998-02-26 WO claimed
WO-1998007811-A2 RINSE ADDED FABRIC SOFTENING COMPOSITIONS AND METHOD OF USE FOR THE DELIVERY OF FRAGRANCE DERIVATIVES THE PROCTER & GAMBLE COMPANY (US) 1998-02-26 WO claimed
EP-0293739-B1 METHOD FOR THE PRODUCTION OF 4-ISOPROPYL-CYCLOHEXYLMETHANOL OR ITS ALKYL ETHERS BASF Aktiengesellschaft (DE) 1990-11-14 EP claimed
US-4847425-A Prepartion of 4-isopropylcyclohexylmethanol and its alkyl ethers BASF AKTIENGESELLSCHAFT (DE) 1989-07-11 US claimed
EP-0293739-A1 Method for the production of 4-isopropyl-cyclohexylmethanol or its alkyl ethers BASF Aktiengesellschaft (DE) 1988-12-07 EP claimed
US-4701278-A ORGANOLEPTIC FIRMENICH SA (CH) 1987-10-20 US claimed
US-3993604-A ORGANOLEPTIC, PERFUMES, FLAVORS FIRMENICH S.A. (CH) 1976-11-23 US claimed