SCHEMBL3620532

SCHEMBL3620532

Cc1c(C(=O)O)oc2ccc(CO[SiH](C)C)c(C(C)(C)C)c12

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 2/20 0.43
KDM4E B2RXH2 5/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MCL1 Q07820 2/20 0.37
ALDH1A1 P00352 3/20 0.36
GPR35 Q9HC97 1/20 0.34
HPGD P15428 2/20 0.34
GAA P10253 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
KLK7 P49862 1/20 0.34
HSD17B10 Q99714 1/20 0.34
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL3608744 0.87 KDM4E (0.51) KDM4EMEN1KMT2AALDH1A1HPGD
SCHEMBL10743811 0.72 EDNRA (0.49) EDNRAKDM4EMEN1KMT2AMCL1
SCHEMBL7391020 0.68 GABRA1 (0.33) HSD17B10
SCHEMBL6761471 0.68 MEN1 (0.31) MEN1KMT2A
SCHEMBL3609574 0.68 EDNRA (0.45) EDNRAKDM4EMEN1KMT2AMCL1
SCHEMBL9869198 0.67 EDNRA (0.47) EDNRAKDM4EMEN1KMT2AMCL1
SCHEMBL27593837 0.65 EDNRA (0.59) EDNRAKDM4EMEN1KMT2AMCL1
SCHEMBL3607209 0.65 EDNRA (0.62) EDNRAKDM4EMCL1ALDH1A1GPR35
SCHEMBL3619348 0.65 EDNRA (0.64) EDNRAKDM4EHPGDGAA
SCHEMBL3614759 0.65 MMP2 (0.54) EDNRAKDM4EMEN1KMT2AMCL1

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-20100137298-A1 Biaryl Sulfonamides and Methods for Using Same WYETH (US) 2010-06-03 US disclosed
EP-1692124-B1 BIARYL SULFONAMIDES AS MMP INHIBITORS WYETH CORP (US) 2008-10-15 EP disclosed
US-7420001-B2 Biaryl sulfonamides and methods for using same WYETH (US) 2008-09-02 US disclosed
US-20050143422-A1 Biaryl sulfonamides and methods for using same WYETH (US) 2005-06-30 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 (2 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-20100137298-A1 Biaryl Sulfonamides and Methods for Using Same STS, MMP3, AADAC EDNRA 3365/4885KDM4E 1421/4885MEN1 4000/4885
US-20050143422-A1 Biaryl sulfonamides and methods for using same STS, MMP3, AADAC EDNRA 3365/4885KDM4E 1421/4885MEN1 4000/4885

“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.