SCHEMBL3608519

SCHEMBL3608519

Cc1c(C(=O)O)oc2cccc(C(=O)N(C)C)c12

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 2/20 0.56
MCL1 Q07820 4/20 0.42
SMN1; SMN2 Q16637 3/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
NPC1 O15118 4/20 0.40
RAB9A P51151 4/20 0.40
MAPT P10636 2/20 0.40
GPR35 Q9HC97 1/20 0.40
KDM4E B2RXH2 5/20 0.38
ALDH1A1 P00352 1/20 0.38
KEAP1 Q14145 1/20 0.38
HSD17B10 Q99714 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
HPGD P15428 3/20 0.36
GAA P10253 1/20 0.36
NPSR1 Q6W5P4 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
SCHEMBL3611915 0.83 EDNRA (0.60) EDNRAMCL1SMN1; SMN2MEN1KMT2A
SCHEMBL3620283 0.82 RAB9A (0.65) SMN1; SMN2MEN1KMT2ANPC1RAB9A
SCHEMBL27593861 0.81 EDNRA (0.63) EDNRAMCL1MEN1KMT2ANPC1
SCHEMBL3618186 0.79 EDNRA (0.56) EDNRAMCL1NPC1RAB9AMAPT
SCHEMBL3611550 0.78 EDNRA (0.59) EDNRAMCL1SMN1; SMN2MEN1KMT2A
SCHEMBL3612485 0.77 EDNRA (0.66) EDNRAMCL1MEN1KMT2ANPC1
SCHEMBL3611742 0.76 MAPT (0.65) EDNRAMCL1MEN1KMT2ANPC1
SCHEMBL3621889 0.75 EDNRA (0.55) EDNRAMCL1SMN1; SMN2MEN1KMT2A
SCHEMBL27870689 0.75 EDNRA (0.55) EDNRAMCL1SMN1; SMN2MEN1KMT2A
SCHEMBL23532015 0.74 EDNRA (0.62) EDNRAMCL1MEN1KMT2ANPC1

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 3365/4885MCL1 1972/4885SMN1; SMN2 3220/4885
US-20050143422-A1 Biaryl sulfonamides and methods for using same STS, MMP3, AADAC EDNRA 3365/4885MCL1 1972/4885SMN1; SMN2 3220/4885

“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.