SCHEMBL679077

SCHEMBL679077

CCCC=C1CC(=O)NC1=O

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HTT P42858 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C19 P33261 1/20 0.38
MEN1 O00255 1/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.34
HPGD P15428 1/20 0.31
TRPA1 O75762 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
SCHEMBL679076 1.00 ALDH1A1 (0.39) ALDH1A1SMN1; SMN2L3MBTL1HTTCYP3A4
SCHEMBL2987621 0.89 CCR6 (0.39) ALDH1A1SMN1; SMN2L3MBTL1HTTCYP3A4
SCHEMBL6835922 0.87 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2L3MBTL1HTTCYP3A4
SCHEMBL27660742 0.87 PRKCA (0.38) ALDH1A1SMN1; SMN2L3MBTL1HTTCYP3A4
SCHEMBL679165 0.85 PRKCA (0.40)
SCHEMBL678544 0.85 PRKCA (0.40)
SCHEMBL7094238 0.85 PRKCA (0.40)
SCHEMBL678545 0.85 PRKCA (0.40)
SCHEMBL679166 0.85 PRKCA (0.40)
SCHEMBL27484349 0.85 PRKCA (0.40)

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2365969-B1 Novel anti-biofilm agents YISSUM RES DEV CO (IL) 2017-03-22 EP disclosed
US-8865909-B2 Anti-biofilm agents YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2014-10-21 US disclosed
CN-101987909-B Processes for producing polyester latexes via solvent-free emulsification XEROX CORP 2013-11-06 CN disclosed
CN-103293887-A Toners with improved dielectric loss XEROX CORP 2013-09-11 CN disclosed
CN-102681375-A Toner compositions and processes XEROX CORP 2012-09-19 CN disclosed
US-20110281921-A1 NOVEL ANTI-BIOFILM AGENTS HADASIT MEDICAL RESEARCH SERVICES AND DEVELOPMENT LTD. (IL) 2011-11-17 US disclosed
EP-2365969-A1 Novel anti-biofilm agents Yissum Research Development Company of The Hebrew University of Jerusalem (IL) 2011-09-21 EP disclosed
CN-101987909-A Processes for producing polyester latexes via solvent-free emulsification XEROX CORP 2011-03-23 CN disclosed
WO-2010058402-A1 NOVEL ANTI-BIOFILM AGENTS YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2010-05-27 WO disclosed
EP-0767790-B1 CONDENSED IMIDAZOLE COMPOUNDS, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2001-12-12 EP disclosed
CN-1046725-C fused imidazole compounds, their preparation and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1999-11-24 CN disclosed
US-5840732-A ANTIDIABETIC AGENTS, AUTOIMMUNE DISEASES OR IMMUNOSUPPRESSANTS TAKEDA CHEMICAL INDUSTRIES LTD. (JP) 1998-11-24 US disclosed
CN-1151161-A fused imidazole compounds, their preparation and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1997-06-04 CN disclosed
EP-0767790-A1 CONDENSED IMIDAZOLE COMPOUNDS, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1997-04-16 EP disclosed
WO-1995035296-A1 CONDENSED IMIDAZOLE COMPOUNDS, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1995-12-28 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 (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-20110281921-A1 NOVEL ANTI-BIOFILM AGENTS PYCARD, DNM2, MMP8 ALDH1A1 1605/4885SMN1; SMN2 4878/4885L3MBTL1 2417/4885

“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.