SCHEMBL3621185

SCHEMBL3621185

O=C(O)c1nc2cc(Cl)ccc2s1.[NaH]

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 1/20 0.56
PPARA Q07869 9/20 0.56
SMN1; SMN2 Q16637 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
LOXL2 Q9Y4K0 1/20 0.49
IDO1 P14902 1/20 0.49
ALOX5 P09917 4/20 0.48
MGAM O43451 1/20 0.47
GAA P10253 1/20 0.47
SI P14410 1/20 0.47
MGAM2 Q2M2H8 1/20 0.47

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
SCHEMBL30515646 0.98 HDAC6 (0.57) HDAC6PPARASMN1; SMN2NPSR1LOXL2
SCHEMBL3643594 0.98 HDAC6 (0.57) HDAC6PPARASMN1; SMN2NPSR1LOXL2
SCHEMBL3641915 0.85 PPARA (0.57) PPARASMN1; SMN2GAA
SCHEMBL11228986 0.85 SMN1; SMN2 (0.54) HDAC6PPARASMN1; SMN2NPSR1LOXL2
SCHEMBL24962530 0.83 SMN1; SMN2 (0.57) HDAC6PPARASMN1; SMN2NPSR1LOXL2
SCHEMBL30209129 0.83 SMN1; SMN2 (0.57) HDAC6PPARASMN1; SMN2NPSR1LOXL2
SCHEMBL3711953 0.83 SMN1; SMN2 (0.53) HDAC6PPARASMN1; SMN2NPSR1LOXL2
SCHEMBL27714125 0.83 PPARA (0.56) PPARASMN1; SMN2GAA
SCHEMBL3621187 0.82 SMN1; SMN2 (0.51) HDAC6PPARASMN1; SMN2NPSR1LOXL2
SCHEMBL28258783 0.81 PPARA (0.54) HDAC6PPARASMN1; SMN2NPSR1ALOX5

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 7 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
EP-1692124-A1 BIARYL SULFONAMIDES AS MMP INHIBITORS Wyeth (US) 2006-08-23 EP disclosed
WO-2005061477-A1 BIARYL SULFONAMIDES AS MMP INHIBITORS WYETH (US) 2005-07-07 WO disclosed
US-20050143422-A1 Biaryl sulfonamides and methods for using same WYETH (US) 2005-06-30 US disclosed
CN-1623537-A Biaryl sulfonamides and its using method WYETH CORP (US) 2005-06-08 CN 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 HDAC6 234/4885PPARA 2386/4885SMN1; SMN2 3220/4885
US-20050143422-A1 Biaryl sulfonamides and methods for using same STS, MMP3, AADAC HDAC6 234/4885PPARA 2386/4885SMN1; 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.