SCHEMBL2852181

SCHEMBL2852181

CC1C(C=O)CC2CC1C2(C)C

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.36
SCN1A P35498 1/20 0.36
SCN2A Q99250 1/20 0.36
SCN3A Q9NY46 1/20 0.36
CYP19A1 P11511 12/20 0.35
CYP17A1 P05093 6/20 0.35
EPHX2 P34913 1/20 0.34
SIGMAR1 Q99720 1/20 0.33
ALDH1A1 P00352 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
SCHEMBL9187247 1.00 TDP1 (0.36) TDP1SCN1ASCN2ASCN3ACYP19A1
SCHEMBL9184208 1.00 TDP1 (0.36) TDP1SCN1ASCN2ASCN3ACYP19A1
SCHEMBL9495178 0.87 SCN1A (0.38) TDP1SCN1ASCN2ASCN3ACYP19A1
SCHEMBL719629 0.81
SCHEMBL14484234 0.79 CNR2 (0.33) SIGMAR1
SCHEMBL14484240 0.79 CNR2 (0.33) SIGMAR1
SCHEMBL9614687 0.78 TDP1 (0.35) TDP1SCN1ASCN2ASCN3ACYP19A1
SCHEMBL9614689 0.78 TDP1 (0.35) TDP1SCN1ASCN2ASCN3ACYP19A1
SCHEMBL12586047 0.78
SCHEMBL12586057 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4711010-A2 PRO-PERFUME COMPOSITIONS Firmenich SA (CH) 2026-03-18 EP claimed
CN-109642184-A Product including plastic containers and composition of matter 西姆莱斯有限公司 2019-04-16 CN claimed
EP-3247779-B1 PHOTOLABILE ACETAL AND KETAL COMPOUNDS FOR THE CONTROLLED RELEASE OF ACTIVE VOLATILE CARBONYL COMPOUNDS FIRMENICH & CIE (CH) 2019-03-13 EP claimed
EP-2822682-B1 MICROCAPSULES AND USES THEREOF FIRMENICH & CIE (CH) 2017-04-26 EP claimed
EP-2748208-B1 PHOTOLABILE LATEX FOR THE RELEASE OF PERFUMES FIRMENICH & CIE (CH) 2016-06-22 EP claimed
US-9334464-B2 Microcapsules and uses thereof FIRMENICH SA (CH) 2016-05-10 US claimed
US-9315763-B2 Photolabile latex for the release of perfumes FIRMENICH SA (CH) 2016-04-19 US claimed
CN-102933193-B Perfuming composition and use thereof FIRMENICH & CIE 2015-06-17 CN claimed
EP-2822682-A1 MICROCAPSULES AND USES THEREOF Firmenich SA (CH) 2015-01-14 EP claimed
US-20140323376-A1 MICROCAPSULES AND USES THEREOF FIRMENICH SA (CH) 2014-10-30 US claimed
EP-2152673-B1 3- TO 7-MEMBERED 1,3-DIAZA-4-OXO-HETEROCYCLIC DERIVATIVES CAPABLE OF RELEASING ACTIVE ALDEHYDES OR KETONES FIRMENICH & CIE (CH) 2014-08-20 EP claimed
WO-2013079435-A1 MICROCAPSULES AND USES THEREOF FIRMENICH SA (CH) 2013-06-06 WO claimed
EP-0558933-A1 Tricyclic ketones, process for their preparation and their use as perfume ingredients FIRMENICH SA (CH) 1993-09-08 EP claimed
EP-0382934-B1 TRICYCLIC KETONES, METHOD OF MAKING THEM AND THEIR APPLICATION AS PERFUME AGENTS FIRMENICH SA (CH) 1993-04-28 EP claimed
EP-0382934-A2 Tricyclic ketones, method of making them and their application as perfume agents FIRMENICH SA (CH) 1990-08-22 EP claimed
JP-3294240-A None JP disclosed
JP-4108755-A None JP disclosed
US-4081477-A AMINOMETHYL DERIVATIVES BASF AKTIENGESELLSCHAFT (DT) 1978-03-28 US disclosed
US-4081477-A AMINOMETHYL DERIVATIVES BASF AKTIENGESELLSCHAFT (DT) 1978-03-28 US disclosed
US-3996246-A Resolution of racemic pantolactone BASF AKTIENGESELLSCHAFT (DT) 1976-12-07 US disclosed