SCHEMBL10073623

SCHEMBL10073623

C=CC(=O)OCc1ccc(-c2ccc(C#N)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 3/20 0.44
GAA P10253 1/20 0.44
MMP2 P08253 4/20 0.43
TSHR P16473 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
MMP13 P45452 3/20 0.43
RAB9A P51151 1/20 0.43
MMP12 P39900 1/20 0.43
MMP1 P03956 1/20 0.40
MMP9 P14780 1/20 0.40
HRH3 Q9Y5N1 1/20 0.40
HDAC2 Q92769 1/20 0.40
ADAMTS4 O75173 1/20 0.40
PTGER4 P35408 1/20 0.40
SMPD1 P17405 1/20 0.39

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
SCHEMBL587685 0.95 GAA (0.47) GAATSHRTDP1RAB9ASMPD1
SCHEMBL16125662 0.87 HCAR2 (0.46) TSHRRAB9A
SCHEMBL12367978 0.87 HCAR2 (0.46) TSHRRAB9A
SCHEMBL29316074 0.85 MMP13 (0.47) MMP3MMP2TSHRMMP13MMP12
SCHEMBL29321446 0.83 TSHR (0.48) MMP3MMP2TSHRMMP13MMP12
SCHEMBL29316079 0.82 TSHR (0.50) MMP3MMP2TSHRMMP13MMP12
SCHEMBL2556244 0.82 HCAR2 (0.50) TSHRTDP1
SCHEMBL2619036 0.81 TSHR (0.52) MMP3MMP2TSHRMMP13MMP12
SCHEMBL21389608 0.81 TSHR (0.52) MMP3MMP2TSHRMMP13MMP12
SCHEMBL13220802 0.81 TSHR (0.52) MMP3MMP2TSHRMMP13MMP12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8361908-B2 Modified surface material, method for preparing same and uses thereof UNIVERSITE PARIS 7-DENIS DIDEROT (FR) 2013-01-29 US disclosed
US-20120015138-A1 MODIFIED SURFACE MATERIAL, METHOD FOR PREPARING SAME AND USES THEREOF ALCHIMEDICS (FR) 2012-01-19 US disclosed
US-8053567-B2 forming undercoatings on semiconductor by polymerizing monomers with diazonium salt which can electrochemical reduction having a polymerization initiator function; in situ free radical polymerization; stents, implants, prostheses; corrosion resistance Universite Paris 7—Denis Diderot (FR) 2011-11-08 US disclosed
EP-1778770-B1 MODIFIED SURFACE MATERIAL, METHOD FOR PREPARING SAME AND USES THEREOF UNIV PARIS 7 DENIS DIDEROT (FR) 2011-11-02 EP disclosed
US-20080064783-A1 Modified Surface Material, Method for Preparing Same and Uses Thereof ALCHIMEDICS (FR) 2008-03-13 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-20080064783-A1 Modified Surface Material, Method for Preparing Same and Uses Thereof SOAT2, SOAT1, INMT MMP3 4306/4885GAA 2217/4885MMP2 4338/4885

“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.