SCHEMBL14660286

SCHEMBL14660286

O=C(CCl)OC(C(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.63
CYP3A4 P08684 4/20 0.63
SMN1; SMN2 Q16637 1/20 0.58
RECQL P46063 1/20 0.53
MEN1 O00255 4/20 0.52
KMT2A Q03164 4/20 0.52
MAPT P10636 3/20 0.52
POLB P06746 2/20 0.52
NPC1 O15118 2/20 0.52
RAB9A P51151 2/20 0.52
CYP2C19 P33261 3/20 0.51
NPSR1 Q6W5P4 2/20 0.51
CYP1A2 P05177 2/20 0.51
CYP2C9 P11712 2/20 0.51
TDP1 Q9NUW8 2/20 0.51
LMNA P02545 3/20 0.49
TRPA1 O75762 1/20 0.48
MAPK1 P28482 1/20 0.48
GSK3B P49841 1/20 0.48
HIF1A Q16665 1/20 0.48

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
SCHEMBL11599668 0.86 ALDH1A1 (0.67) ALDH1A1CYP3A4SMN1; SMN2RECQLMEN1
SCHEMBL11681237 0.84 KLK7 (0.44) ALDH1A1CYP3A4SMN1; SMN2RECQLLMNA
SCHEMBL29094176 0.84 KLK7 (0.44) ALDH1A1CYP3A4SMN1; SMN2RECQLLMNA
SCHEMBL27632520 0.83 ALDH1A1 (0.68) ALDH1A1CYP3A4SMN1; SMN2RECQLMEN1
SCHEMBL10368135 0.83 KLK7 (0.43) ALDH1A1CYP3A4SMN1; SMN2RECQLCYP2C19
SCHEMBL750021 0.82 ALDH1A1 (0.61) ALDH1A1CYP3A4SMN1; SMN2RECQLMEN1
SCHEMBL14662860 0.81 ALDH1A1 (0.59) ALDH1A1CYP3A4SMN1; SMN2RECQLMEN1
SCHEMBL13158231 0.81 ALDH1A1 (0.69) ALDH1A1CYP3A4SMN1; SMN2RECQLMEN1
SCHEMBL14663002 0.81 ALDH1A1 (0.59) ALDH1A1CYP3A4SMN1; SMN2RECQLMEN1
SCHEMBL9474373 0.81 ALDH1A1 (0.64) ALDH1A1CYP3A4SMN1; SMN2RECQLMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2734519-B1 ANTI-BIOFILM COMPOUNDS UNIV LOUISVILLE RES FOUND (US) 2016-05-04 EP disclosed
EP-2734519-B1 ANTI-BIOFILM COMPOUNDS UNIV LOUISVILLE RES FOUND (US) 2016-05-04 EP disclosed
US-9167820-B2 Anti-biofilm compounds UNIVERSITY OF LOUISVILLE RESEARCH FOUNDATION, INC. (US) 2015-10-27 US disclosed
US-9167820-B2 Anti-biofilm compounds UNIVERSITY OF LOUISVILLE RESEARCH FOUNDATION, INC. (US) 2015-10-27 US disclosed
US-9167820-B2 Anti-biofilm compounds UNIVERSITY OF LOUISVILLE RESEARCH FOUNDATION, INC. (US) 2015-10-27 US disclosed
US-20140161845-A1 ANTI-BIOFILM COMPOUNDS UNIVERSITY OF LOUISVILLE RESEARCH FOUNDATION INC. (US) 2014-06-12 US disclosed
US-20140161845-A1 ANTI-BIOFILM COMPOUNDS UNIVERSITY OF LOUISVILLE RESEARCH FOUNDATION INC. (US) 2014-06-12 US disclosed
US-20140161845-A1 ANTI-BIOFILM COMPOUNDS UNIVERSITY OF LOUISVILLE RESEARCH FOUNDATION INC. (US) 2014-06-12 US disclosed
EP-2734519-A1 ANTI-BIOFILM COMPOUNDS University Of Louisville Research Foundation, Inc. (US) 2014-05-28 EP disclosed
WO-2013016206-A1 ANTI-BIOFILM COMPOUNDS UNIVERSITY OF LOUISVILLE RESEARCH FOUNDATION, INC. (US) 2013-01-31 WO disclosed
WO-2013016206-A1 ANTI-BIOFILM COMPOUNDS UNIVERSITY OF LOUISVILLE RESEARCH FOUNDATION, INC. (US) 2013-01-31 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-20140161845-A1 ANTI-BIOFILM COMPOUNDS MSR1, NPR1, FPR1 ALDH1A1 3602/4885CYP3A4 3902/4885SMN1; SMN2 4826/4885

“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.