SCHEMBL169910

SCHEMBL169910

C=CCN(CC=C)NC(=O)O

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.38
LMNA P02545 2/20 0.36
ALOX15 P16050 1/20 0.33
HSD17B10 Q99714 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.31
TSHR P16473 1/20 0.30
HPGD P15428 1/20 0.30
ALOX12 P18054 1/20 0.30
CCR6 P51684 1/20 0.30
MEN1 O00255 2/20 0.30
KMT2A Q03164 2/20 0.30
KDM4E B2RXH2 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
Phenol SCHEMBL27943068 0.83 ESR1 (0.44) ALDH1A1LMNASMN1; SMN2TSHRHPGD
SCHEMBL6694454 0.82 ALDH1A1 (0.39) ALDH1A1LMNAALOX15HSD17B10SMN1; SMN2
SCHEMBL4352238 0.78 ALDH1A1 (0.37) ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL3263644 0.78 ALDH1A1 (0.37) ALDH1A1TSHR
SCHEMBL7736055 0.78 ALDH1A1 (0.42) ALDH1A1LMNAALOX15HSD17B10SMN1; SMN2
SCHEMBL9750201 0.78 ALDH1A1 (0.37) ALDH1A1MEN1KMT2A
Hydrochloric Acid SCHEMBL9820028 0.76 ALDH1A1 (0.35) ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL5606415 0.75 ALDH1A1 (0.36) ALDH1A1SMN1; SMN2TSHRHPGDMEN1
Hydrochloric Acid SCHEMBL9062504 0.73 GAA (0.35) ALDH1A1LMNAALOX15HSD17B10HPGD
SCHEMBL5461842 0.73 ALDH1A1 (0.33) ALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3064199-B1 ABUSE-DETERRENT TRANSDERMAL FORMULATIONS OF OPIATE AGONISTS AND AGONIST-ANTAGONISTS BUZZZ PHARMACEUTICALS LTD (IE) 2023-12-20 EP claimed
US-20150197484-A1 USE OF CANNABIDIOL PRODRUGS IN TOPICAL AND TRANSDERMAL ADMINISTRATION WITH MICRONEEDLES ZYNERBA PHARMACEUTICALS, INC. (US) 2015-07-16 US claimed
WO-2012148550-A1 PRODRUGS OF THERAPEUTIC COMPOUNDS MYREXIS, INC. (US) 2012-11-01 WO claimed
EP-2473475-A1 USE OF CANNABIDIOL PRODRUGS IN TOPICAL AND TRANSDERMAL ADMINISTRATION WITH MICRONEEDLES AllTranz Inc. (US) 2012-07-11 EP claimed
US-20110052694-A1 USE OF CANNABIDIOL PRODRUGS IN TOPICAL AND TRANSDERMAL ADMINISTRATION WITH MICRONEEDLES ALLTRANZ INC. (US) 2011-03-03 US claimed
WO-2011026144-A1 USE OF CANNABIDIOL PRODRUGS IN TOPICAL AND TRANSDERMAL ADMINISTRATION WITH MICRONEEDLES ALLTRANZ INC. (US) 2011-03-03 WO claimed
EP-2176208-A1 PRODRUGS OF CANNABIDIOL, COMPOSITIONS COMPRISING PRODRUGS OF CANNABIDIOL AND METHODS OF USING THE SAME AllTranz Inc. (US) 2010-04-21 EP claimed
US-20090036523-A1 PRODRUGS OF CANNABIDIOL, COMPOSITIONS COMPRISING PRODRUGS OF CANNABIDIOL AND METHODS OF USING THE SAME ALLTRANZ INC. (US) 2009-02-05 US claimed
WO-2009018389-A1 PRODRUGS OF CANNABIDIOL, COMPOSITIONS COMPRISING PRODRUGS OF CANNABIDIOL AND METHODS OF USING THE SAME ALLTRANZ INC. (US) 2009-02-05 WO claimed
EP-1392718-B1 IMPROVED NATIVE CHEMICAL LIGATION WITH THREE OR MORE COMPONENTS GENEPROT INC (CH) 2006-01-11 EP claimed
US-20050064538-A1 Native chemical ligation with three or more components ASTRAZENECA PHARMACEUTICALS LP 2005-03-24 US claimed
EP-1392718-A2 IMPROVED NATIVE CHEMICAL LIGATION WITH THREE OR MORE COMPONENTS Geneprot, Inc. (CH) 2004-03-03 EP claimed
WO-2002098902-A2 IMPROVED NATIVE CHEMICAL LIGATION WITH THREE OR MORE COMPONENTS GENEPROT, INC. (CH) 2002-12-12 WO claimed
US-11873272-B2 Antimicrobial and antiviral sulfur containing glycerol monoester derivatives Niche Biopharmaceuticals LLC (US) 2024-01-16 US disclosed
EP-3064199-B1 ABUSE-DETERRENT TRANSDERMAL FORMULATIONS OF OPIATE AGONISTS AND AGONIST-ANTAGONISTS BUZZZ PHARMACEUTICALS LTD (IE) 2023-12-20 EP disclosed
EP-4214191-A1 ANTIMICROBIAL AND ANTIVIRAL SULFUR CONTAINING GLYCEROL MONOESTER DERIVATIVES Niche Biopharmaceuticals LLC (US) 2023-07-26 EP disclosed
EP-1392718-B1 IMPROVED NATIVE CHEMICAL LIGATION WITH THREE OR MORE COMPONENTS GENEPROT INC (CH) 2006-01-11 EP disclosed
US-20050064538-A1 Native chemical ligation with three or more components ASTRAZENECA PHARMACEUTICALS LP 2005-03-24 US disclosed
EP-1392718-A2 IMPROVED NATIVE CHEMICAL LIGATION WITH THREE OR MORE COMPONENTS Geneprot, Inc. (CH) 2004-03-03 EP disclosed
WO-2002098902-A2 IMPROVED NATIVE CHEMICAL LIGATION WITH THREE OR MORE COMPONENTS GENEPROT, INC. (CH) 2002-12-12 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 (5 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-20090036523-A1 PRODRUGS OF CANNABIDIOL, COMPOSITIONS COMPRISING PRODRUGS OF CANNABIDIOL AND METHODS OF USING THE SAME CNR2, CNR1, FAAH ALDH1A1 1490/4885LMNA 1353/4885ALOX15 388/4885
US-20110052694-A1 USE OF CANNABIDIOL PRODRUGS IN TOPICAL AND TRANSDERMAL ADMINISTRATION WITH MICRONEEDLES PNLIP, CNR2, CNR1 ALDH1A1 3684/4885LMNA 3547/4885ALOX15 516/4885
US-20050064538-A1 Native chemical ligation with three or more components VIP, PTMS, FGB ALDH1A1 2856/4885LMNA 2989/4885ALOX15 4204/4885
US-11873272-B2 Antimicrobial and antiviral sulfur containing glycerol monoester derivatives MAVS, SARS1, MGLL ALDH1A1 3686/4885LMNA 4761/4885ALOX15 2289/4885
US-20150197484-A1 USE OF CANNABIDIOL PRODRUGS IN TOPICAL AND TRANSDERMAL ADMINISTRATION WITH MICRONEEDLES PNLIP, CNR2, CNR1 ALDH1A1 3684/4885LMNA 3547/4885ALOX15 516/4885

“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.