SCHEMBL358215

SCHEMBL358215

CCCCCCCNC1=CC(=O)c2c(OC)ccc(OC)c2C1=O

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SOAT1 P35610 12/20 0.57
APAF1 O14727 1/20 0.46
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.44
MAPK1 P28482 1/20 0.44
HTT P42858 1/20 0.44
ALOX5 P09917 6/20 0.41

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
SCHEMBL369253 1.00 SOAT1 (0.57) SOAT1APAF1ALDH1A1LMNAMAPK1
SCHEMBL2485219 1.00 SOAT1 (0.57) SOAT1APAF1ALDH1A1LMNAMAPK1
SCHEMBL15732916 1.00 SOAT1 (0.57) SOAT1APAF1ALDH1A1LMNAMAPK1
SCHEMBL368936 1.00 SOAT1 (0.57) SOAT1APAF1ALDH1A1LMNAMAPK1
SCHEMBL15733152 0.99 SOAT1 (0.56) SOAT1APAF1ALDH1A1LMNAMAPK1
SCHEMBL15733049 0.94 SOAT1 (0.56) SOAT1APAF1ALDH1A1MAPK1HTT
SCHEMBL15732826 0.89 SOAT1 (0.51) SOAT1APAF1ALDH1A1LMNAMAPK1
SCHEMBL2484804 0.83 SOAT1 (0.50) SOAT1APAF1ALDH1A1LMNAMAPK1
SCHEMBL20098762 0.79 ALDH1A1 (0.49) APAF1ALDH1A1ALOX5
SCHEMBL10895412 0.78 ALDH1A1 (0.48) APAF1ALDH1A1MAPK1ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3182129-B1 METHOD OF SCREENING A THERAPEUTIC AGENT FOR K-RAS MUTANT CANCER RAND BIO SCIENCE INC (KR) 2018-12-26 EP disclosed
EP-3182129-A1 CHEMICAL INHIBITOR OF P53-SNAIL BINDING AND PHARMACEUTICAL COMPOSITION FOR TREATING CANCER DISEASE CONTAINING SAME AS ITS ACTIVE INGREDIENT RAND Bio Science Inc. (KR) 2017-06-21 EP disclosed
US-9400281-B2 Method of screening of therapeutic agents for K-Ras mutant driven cancers PUSAN NATIONAL UNIVERSITY INDUSTRY-UNIVERSITY COOPERATION FOUNDATION (KR) 2016-07-26 US disclosed
US-20140147866-A1 COMPOUND FOR INHIBITING SNAIL-P53 BINDING AND THERAPEUTIC AGENT FOR CANCER INCLUDING THE COMPOUND AS EFFECTIVE COMPONENT THE INDUSTRY & ACADEMIC COOPERATION IN CHUNGNAM NATIONAL UNIVERSITY (KR) 2014-05-29 US disclosed
US-20120015960-A1 CHEMICAL INHIBITOR OF P53-SNAIL BINDING AND PHARMACEUTICAL COMPOSITION FOR TREATING CANCER DISEASE CONTAINING SAME AS ITS ACTIVE INGREDIENT THE INDUSTRY & ACADEMIC COOPERATION IN CHUNGNAM NATIONAL UNIVERSITY (KR) 2012-01-19 US disclosed
EP-2377849-A2 CHEMICAL INHIBITOR OF P53-SNAIL BINDING AND PHARMACEUTICAL COMPOSITION FOR TREATING CANCER DISEASE CONTAINING SAME AS ITS ACTIVE INGREDIENT Pusan National University Industry-University Cooperation Foundation (KR) 2011-10-19 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-20120015960-A1 CHEMICAL INHIBITOR OF P53-SNAIL BINDING AND PHARMACEUTICAL COMPOSITION FOR TREATING CANCER DISEASE CONTAINING SAME AS ITS ACTIVE INGREDIENT TP53, TP53BP1, KRAS SOAT1 2850/4885APAF1 1291/4885ALDH1A1 1990/4885

“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.