SCHEMBL1715341

SCHEMBL1715341

CCCCCCCC=Cc1ccccc1CON

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 2/20 0.43
CYSLTR1 Q9Y271 2/20 0.43
IDO1 P14902 12/20 0.39
MMP2 P08253 2/20 0.36
F7 P08709 2/20 0.36
F3 P13726 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
ALOX15 P16050 1/20 0.36
ECE1 P42892 1/20 0.36
SGMS1 Q86VZ5 1/20 0.36
SGMS2 Q8NHU3 1/20 0.36
MUS81 Q96NY9 1/20 0.36
HSD17B10 Q99714 1/20 0.36
SAE1 Q9UBE0 1/20 0.36

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
SCHEMBL1715340 1.00 CYSLTR2 (0.43) CYSLTR2CYSLTR1IDO1MMP2F7
SCHEMBL11127905 0.88 CYSLTR2 (0.44) CYSLTR2CYSLTR1MMP2F7F3
Ether SCHEMBL11047230 0.84 CYSLTR2 (0.42) CYSLTR2CYSLTR1MMP2F7F3
SCHEMBL27875985 0.81 F7 (0.49) CYSLTR2CYSLTR1MMP2F7F3
SCHEMBL10482163 0.80 CYSLTR2 (0.48) CYSLTR2CYSLTR1MMP2F7F3
SCHEMBL10617350 0.80 CYSLTR2 (0.48) CYSLTR2CYSLTR1MMP2F7F3
SCHEMBL10482169 0.80 CYSLTR2 (0.48) CYSLTR2CYSLTR1MMP2F7F3
SCHEMBL10383342 0.80 CYSLTR2 (0.48) CYSLTR2CYSLTR1MMP2F7F3
SCHEMBL6434846 0.80 BACE1 (0.51) CYSLTR2CYSLTR1
SCHEMBL6436782 0.80 BACE1 (0.51) CYSLTR2CYSLTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070244117-A1 Novel Hydroxamic Acid Esters and Pharmaceutical Use Thereof LEO PHARMA A/S (DK) 2007-10-18 US claimed
US-8034811-B2 Hydroxamic acid esters and pharmaceutical use thereof LEO PHARMA A/S (DK) 2011-10-11 US disclosed
EP-1697312-B1 HYDROXAMIC ACID ESTERS AND PHARMACEUTICAL USE THEREOF LEO PHARMA AS (DK) 2011-07-20 EP disclosed
US-20070244117-A1 Novel Hydroxamic Acid Esters and Pharmaceutical Use Thereof LEO PHARMA A/S (DK) 2007-10-18 US 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-20070244117-A1 Novel Hydroxamic Acid Esters and Pharmaceutical Use Thereof F9, F12, HDAC9 CYSLTR2 2916/4885CYSLTR1 2115/4885IDO1 3029/4885

“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.