SCHEMBL1916495

SCHEMBL1916495

CCCCC/C=C/C=C/C(=O)NC(C)CC

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 4/20 0.62
CNR1 P21554 3/20 0.62
FAAH O00519 4/20 0.50
KDM4E B2RXH2 1/20 0.47
FASN P49327 1/20 0.46
ALDH1A1 P00352 2/20 0.43
KCNK3 O14649 1/20 0.43
THRB P10828 1/20 0.43
BLM P54132 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
TSHR P16473 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
SCHEMBL17556046 1.00 CNR2 (0.62) CNR2CNR1FAAHKDM4EFASN
SCHEMBL1917358 1.00 CNR2 (0.62) CNR2CNR1FAAHKDM4EFASN
SCHEMBL12367711 0.98 CNR1 (0.65) CNR2CNR1FAAHKDM4EFASN
SCHEMBL17556080 0.87 CNR1 (0.66) CNR2CNR1FAAHKDM4EFASN
SCHEMBL1916843 0.87 CNR1 (0.66) CNR2CNR1FAAHKDM4EFASN
SCHEMBL1917360 0.87 CNR1 (0.66) CNR2CNR1FAAHKDM4EFASN
Bicarbonate SCHEMBL14972866 0.87 CNR2 (0.58) CNR2CNR1FAAHKDM4EFASN
SCHEMBL8002446 0.83 CNR1 (0.65) CNR2CNR1FAAHKDM4EFASN
SCHEMBL8002448 0.83 CNR1 (0.65) CNR2CNR1FAAHKDM4EFASN
SCHEMBL7211383 0.83 CNR1 (0.65) CNR2CNR1FAAHKDM4EFASN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2158894-B1 Oral cleansing agent HENKEL AG & CO KGAA (DE) 2018-11-07 EP disclosed
EP-2140853-B1 Coated particle for use in cosmetics HENKEL AG & CO KGAA (DE) 2018-07-18 EP disclosed
EP-2347754-B1 Oral and tooth care and cleaning agents with alkylpyridinium salts I HENKEL AG & CO KGAA (DE) 2018-01-24 EP disclosed
EP-2347753-B1 Oral and tooth care and cleaning agents with alkylpyridine salts II HENKEL AG & CO KGAA (DE) 2016-12-28 EP disclosed
EP-3003498-A1 TOOTHPASTE CONTAINING FLUORIDE AND POLYLACTIC ACID PARTICLES Henkel AG & Co. KGaA (DE) 2016-04-13 EP disclosed
EP-3003499-A1 ORAL AND DENTAL HYGIENE- AND CLEANING AGENTS WITH IMPROVED ANTI-BACTERIAL ACTION Henkel AG & Co. KGaA (DE) 2016-04-13 EP disclosed
EP-3003500-A1 ORAL AND DENTAL HYGIENE- AND CLEANING AGENTS FOR SENSITIVE TEETH Henkel AG & Co. KGaA (DE) 2016-04-13 EP disclosed
US-20160067170-A1 ORAL AND DENTAL HYGIENE AND CLEANING AGENTS WITH IMPROVED ANTI-BACTERIAL ACTION HENKEL AG & CO. KGAA (DE) 2016-03-10 US disclosed
US-20160067168-A1 ORAL AND DENTAL HYGIENE AND CLEANING AGENTS FOR SENSITIVE TEETH HENKEL AG & CO. KGAA (DE) 2016-03-10 US disclosed
US-20160067171-A1 ORAL AND DENTAL HYGIENE AND CLEANING AGENTS WITH OPTIMIZED TASTE HENKEL AG & CO. KGAA (DE) 2016-03-10 US disclosed
EP-1880705-A2 Brightening and/or colouring composition with improved product sensation HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2008-01-23 EP disclosed
WO-2007147815-A1 DENTAL TREATMENT COMPOSITION WITH INCREASED BLEACHING EFFECT HENKEL AG & CO. KGAA (DE) 2007-12-27 WO disclosed
EP-1842573-A2 Brightening and/or colouring agent with improved product sensation Henkel Kommanditgesellschaft auf Aktien (DE) 2007-10-10 EP disclosed
WO-2007085428-A2 MOUTH AND TOOTH CARE AND CLEANSING AGENT COMPRISING ENZYMES HENKEL AG & CO. KGAA (DE) 2007-08-02 WO disclosed
EP-1806124-A1 Dental preparations comprising enzymes HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-07-11 EP disclosed
EP-1806126-A1 Dental preparations comprising enzymes HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-07-11 EP disclosed
EP-1774955-A2 Ready-to-use mounthwash Henkel Kommanditgesellschaft auf Aktien (DE) 2007-04-18 EP disclosed
EP-1774953-A2 Mouthwash concentrate Henkel Kommanditgesellschaft auf Aktien (DE) 2007-04-18 EP disclosed
EP-1774954-A2 Mouthwash and dentifrice and cleansing composition Henkel Kommanditgesellschaft auf Aktien (DE) 2007-04-18 EP disclosed
EP-1774956-A2 Mouthwash and dentifrice and cleansing composition Henkel Kommanditgesellschaft auf Aktien (DE) 2007-04-18 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 (3 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-20160067170-A1 ORAL AND DENTAL HYGIENE AND CLEANING AGENTS WITH IMPROVED ANTI-BACTERIAL ACTION USP39, USP30, SOD1 CNR2 4640/4885CNR1 4665/4885FAAH 2064/4885
US-20160067168-A1 ORAL AND DENTAL HYGIENE AND CLEANING AGENTS FOR SENSITIVE TEETH SI, H1-0, POLD1 CNR2 4395/4885CNR1 4192/4885FAAH 957/4885
US-20160067171-A1 ORAL AND DENTAL HYGIENE AND CLEANING AGENTS WITH OPTIMIZED TASTE SORD, TAS2R40, TREH CNR2 3212/4885CNR1 3786/4885FAAH 2136/4885

“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.