SCHEMBL696105

SCHEMBL696105

CCC(=O)CCCCCCCCCCCCCCc1cccc2ccccc12

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 2/20 0.48
CDYL Q9Y232 1/20 0.47
TDP1 Q9NUW8 1/20 0.46
IAPP P10997 1/20 0.45
MCL1 Q07820 2/20 0.45
CYP4F2 P78329 1/20 0.44
CYP4A11 Q02928 1/20 0.44
KDM4E B2RXH2 1/20 0.44
NQO2 P16083 1/20 0.43

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
SCHEMBL8400463 0.87 IAPP (0.58) MTNR1ACDYLTDP1IAPPMCL1
SCHEMBL6842066 0.83 TDP1 (0.59) MTNR1ATDP1MCL1
SCHEMBL1616841 0.83 TDP1 (0.59) MTNR1ATDP1MCL1
SCHEMBL3732554 0.83 TDP1 (0.59) MTNR1ATDP1MCL1
SCHEMBL29865501 0.83 TDP1 (0.59) MTNR1ATDP1MCL1
SCHEMBL29865603 0.83 TDP1 (0.59) MTNR1ATDP1MCL1
SCHEMBL710750 0.83 TDP1 (0.59) MTNR1ATDP1MCL1
SCHEMBL11414169 0.83 TDP1 (0.59) MTNR1ATDP1MCL1
SCHEMBL6472220 0.81 TDP1 (0.57) MTNR1ATDP1MCL1
SCHEMBL6472349 0.81 TDP1 (0.57) MTNR1ATDP1MCL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3856130-B1 ANTIPERSPIRANT OR DEODORANT COMPOSITION FIRMENICH & CIE (CH) 2024-06-12 EP claimed
EP-3325707-B1 COMPOSITIONS FOR MALODOR REDUCTION AND USE THEREOF AGILEX FLAVORS & FRAGRANCES INC (US) 2021-09-29 EP claimed
EP-1894603-B1 Encapsulation of bulky fragrance molecules TAKASAGO PERFUMERY CO LTD (JP) 2014-11-19 EP claimed
EP-1515681-B1 NON-CRYSTALLINE PERFUME OR FLAVOUR DELIVERY SYSTEM FIRMENICH & CIE (CH) 2008-09-24 EP claimed
EP-1776402-B1 TIN-FREE, HIGH-MELTING REACTION PRODUCTS OF CARBONYL-HYDROGENATED KETONE ALDEHYDE RESINS, HYDROGENATED KETONE RESINS, AND CARBONYL-HYDROGENATED AND CORE-HYDROGENATED KETONE ALDEHYDE RESINS BASED ON AROMATIC KETONES AND POLYISOCYANATES EVONIK DEGUSSA GMBH (DE) 2007-11-14 EP claimed
EP-0299561-B1 Perfume and bleach compositions UNILEVER NV (NL) 1996-01-10 EP claimed
EP-0320625-B1 Use of odorous products, especially in vacuum cleaners VORWERK CO INTERHOLDING (DE) 1994-09-14 EP claimed
EP-3645157-B1 PROCESS FOR PREPARING A MICROCAPSULE SLURRY FIRMENICH & CIE (CH) 2023-09-27 EP disclosed
US-11291969-B2 Process for preparing microcapsules FIRMENICH SA (CH) 2022-04-05 US disclosed
US-11091722-B2 Compound having a muguet odor FIRMENICH SA (CH) 2021-08-17 US disclosed
US-10876078-B2 Process for the preparation of microcapsules FIRMENICH SA (CH) 2020-12-29 US disclosed
US-20200129947-A1 PROCESS FOR PREPARING MICROCAPSULES FIRMENICH SA (CH) 2020-04-30 US disclosed
EP-3247490-B1 PROCESS FOR THE PREPARATION OF MICROCAPSULES FREE FROM MELAMINE-FORMALDEHYDE FIRMENICH & CIE (CH) 2020-04-29 EP disclosed
EP-0664286-B1 Tetralin nitriles, their use as ingredients for perfumes and oxime intermediates for their preparation FIRMENICH & CIE (CH) 1998-04-22 EP disclosed
EP-0707575-A1 USE OF DIHYDROBENZOFURANONES AS SCENTING INGREDIENTS FIRMENICH SA (CH) 1996-04-24 EP disclosed
EP-0685444-A1 Aromatic compounds and their use in perfumery FIRMENICH SA (CH) 1995-12-06 EP disclosed
EP-0504592-B1 Tertiary alcohol with a campholene substructure unit and its use as a perfumery ingredient FIRMENICH & CIE (CH) 1995-05-10 EP disclosed
EP-0339299-B1 Odorous bicyclic ester FIRMENICH & CIE (CH) 1994-11-30 EP disclosed
WO-1994012143-A2 USE OF FURANONES AS SCENTING INGREDIENTS FIRMENICH SA (CH) 1994-06-09 WO disclosed
EP-0339299-A2 Odorous bicyclic ester FIRMENICH SA (CH) 1989-11-02 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11091722-B2 Compound having a muguet odor PNMT, CNOT1, OPRM1 MTNR1A 288/4885CDYL 1324/4885TDP1 4300/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.