SCHEMBL2959651

SCHEMBL2959651

NC(=O)C12CCCCC1C2C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
UGT2B7 P16662 1/20 0.33
SLC6A12 P48065 1/20 0.32
SLC6A11 P48066 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
SCHEMBL3384132 0.68 UGT2B7 (0.53) UGT2B7
SCHEMBL28161277 0.68 LMNA (0.36) UGT2B7SLC6A12SLC6A11
SCHEMBL28161233 0.68 LMNA (0.36) UGT2B7SLC6A12SLC6A11
SCHEMBL27764954 0.64 EPHX1 (0.31)
SCHEMBL10776004 0.64 UGT2B7 (0.35) UGT2B7
SCHEMBL10776006 0.64 UGT2B7 (0.35) UGT2B7
SCHEMBL16638026 0.63 KDM4E (0.32)
SCHEMBL3986262 0.63 UGT2B7 (0.40) UGT2B7
SCHEMBL28160745 0.61 LMNA (0.33) UGT2B7SLC6A12SLC6A11
SCHEMBL28161234 0.61 LMNA (0.33) UGT2B7SLC6A12SLC6A11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200054057-A1 USE OF ACETYLENIC FATTY ACID COMPOUNDS AS KOKUMI FLAVOR TAKASAGO INTERNATIONAL CORPORATION (JP) 2020-02-20 US disclosed
WO-2018202862-A1 USE OF ACETYLENIC FATTY ACID COMPOUNDS AS KOKUMI FLAVOR TAKASAGO INTERNATIONAL CORPORATION (JP) 2018-11-08 WO disclosed
EP-3398442-A1 USE OF ACETYLENIC FATTY ACID COMPOUNDS AS KOKUMI FLAVOR Takasago International Corporation (JP) 2018-11-07 EP disclosed
US-9894921-B2 Use of cinnamic acid derivatives containing nitrogen as flavouring agents SYMRISE AG (DE) 2018-02-20 US disclosed
US-20150272185-A1 USE OF CINNAMIC ACID DERIVATIVES CONTAINING NITROGEN AS FLAVOURING AGENTS SYMRISE AG (DE) 2015-10-01 US disclosed
US-9144248-B2 Cinnamamides as savory flavorings SYMRISE AG (DE) 2015-09-29 US disclosed
US-8871288-B2 Aromatic neomenthylamides as flavoring substances SYMRISE AG (DE) 2014-10-28 US disclosed
US-8852664-B2 Neo-menthyl derivatives as flavor materials SYMRISE AG (DE) 2014-10-07 US disclosed
US-8487133-B2 Substituted bicyclo [4.1.0] heptane-7-carboxylic acid amides and derivatives thereof as food flavor substances SYMRISE AG (DE) 2013-07-16 US disclosed
US-20130178534-A1 N-Nonanoylvanillylamine as an agent for reducing the appetite, as an agent for imparting a feeling of fullness and as a mood enhancer, and corresponding substance mixtures, orally consumable products and methods SYMRISE AG (DE) 2013-07-11 US disclosed
US-8309158-B2 Composition for reducing the NaCl content in food products SYMRISE AG (DE) 2012-11-13 US disclosed
US-8273398-B2 Geranylamine derivates of oxalic acid SYMRISE AG (DE) 2012-09-25 US disclosed
US-20100189863-A1 SUBSTITUTED BICYCLO [4.1.0] HEPTANE-7-CARBOXYLIC ACID AMIDES AND DERIVATIVES THEREOF AS FOOD FLAVOR SUBSTANCES SYMRISE GMBH & CO.KG (DE) 2010-07-29 US disclosed
US-20100080880-A1 GERANYLAMINE DERIVATES OF OXALIC ACID SYMRISE GMBH & CO. KG (DE) 2010-04-01 US disclosed
US-20100028496-A1 Composition for reducing the NaCl content in food products SYMRISE GMBH & CO. KG (DE) 2010-02-04 US disclosed
US-20090311401-A1 Neo-Menthyl Derivatives as Flavor Materials SYMRISE GMBH & CO. KG (DE) 2009-12-17 US disclosed
CN-101528060-A Substituted bicyclo[4.1.0]heptane-7-carboxylic acid amides and derivatives thereof as food flavor substances SYMRISE GMBH & CO KG (DE) 2009-09-09 CN disclosed
EP-2079322-A1 SUBSTITUTED BICYCLOÝ4.1.0¨HEPTANE-7-CARBOXYLIC ACID AMIDES AND DERIVATIVES THEREOF AS FOOD FLAVOR SUBSTANCES Symrise GmbH & Co. KG (DE) 2009-07-22 EP disclosed
US-20090110796-A1 AROMATIC NEOMENTHYLAMIDES AS FLAVORING SUBSTANCES SYMRISE GMBH & CO. KG (DE) 2009-04-30 US disclosed
WO-2008046895-A1 SUBSTITUTED BICYCLO[4.1.0]HEPTANE-7-CARBOXYLIC ACID AMIDES AND DERIVATIVES THEREOF AS FOOD FLAVOR SUBSTANCES SYMRISE GMBH & CO. KG (DE) 2008-04-24 WO 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 (4 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-20100189863-A1 SUBSTITUTED BICYCLO [4.1.0] HEPTANE-7-CARBOXYLIC ACID AMIDES AND DERIVATIVES THEREOF AS FOOD FLAVOR SUBSTANCES HCAR3, TAS2R1, HCAR1 UGT2B7 1303/4885SLC6A12 2424/4885SLC6A11 1932/4885
US-20090110796-A1 AROMATIC NEOMENTHYLAMIDES AS FLAVORING SUBSTANCES AOC3, NPR3, AOC2 UGT2B7 1062/4885SLC6A12 1159/4885SLC6A11 787/4885
US-20100080880-A1 GERANYLAMINE DERIVATES OF OXALIC ACID OTC, OAT, ODC1 UGT2B7 213/4885SLC6A12 414/4885SLC6A11 1581/4885
US-20130178534-A1 N-Nonanoylvanillylamine as an agent for reducing the appetite, as an agent for imparting a feeling of fullness and as a mood enhancer, and corresponding substance mixtures, orally consumable products and methods MC4R, PNMT, AANAT UGT2B7 2410/4885SLC6A12 599/4885SLC6A11 473/4885

“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.