SCHEMBL2928482

SCHEMBL2928482

CC(=O)NS(=O)(=O)c1ccc(CN)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.66
DHFR P00374 1/20 0.66
TSHR P16473 1/20 0.66
TDP1 Q9NUW8 1/20 0.66
KDM4E B2RXH2 2/20 0.59
PSIP1 O75475 1/20 0.56
CA1 P00915 5/20 0.54
CA2 P00918 5/20 0.54
CA9 Q16790 2/20 0.53
EPHX2 P34913 1/20 0.52
PKM P14618 1/20 0.51
POLB P06746 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.50
CA12 O43570 1/20 0.50
CA4 P22748 1/20 0.50
CA6 P23280 1/20 0.50
CA5A P35218 1/20 0.50
CA7 P43166 1/20 0.50
CA14 Q9ULX7 1/20 0.50
CA5B Q9Y2D0 1/20 0.50

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
Sulfacetamide SCHEMBL5015229 0.88 SMN1; SMN2 (0.69) SMN1; SMN2DHFRTSHRTDP1KDM4E
SCHEMBL28291995 0.86 TSHR (0.67) SMN1; SMN2DHFRTSHRTDP1CA1
SCHEMBL27600086 0.84 SMN1; SMN2 (0.56) SMN1; SMN2DHFRTSHRTDP1KDM4E
SCHEMBL12700752 0.84 SMN1; SMN2 (0.62) SMN1; SMN2DHFRTSHRTDP1CA2
SCHEMBL27582789 0.84 CA1 (0.56) SMN1; SMN2DHFRTSHRTDP1KDM4E
SCHEMBL4636140 0.83 SMN1; SMN2 (0.50) SMN1; SMN2DHFRTSHRTDP1KDM4E
SCHEMBL28146078 0.83 SMN1; SMN2 (0.51) SMN1; SMN2DHFRTSHRTDP1KDM4E
SCHEMBL27319210 0.83 CA1 (0.60) SMN1; SMN2KDM4EPSIP1CA1CA2
SCHEMBL13648079 0.81 SMN1; SMN2 (0.59) SMN1; SMN2DHFRTSHRTDP1KDM4E
SCHEMBL13966984 0.81 SMN1; SMN2 (0.59) SMN1; SMN2DHFRTSHRTDP1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101460198-B Thermosensitive polyphosphazene-bioactive molecule conjugate, preparation method and application thereof KOREA INST SCI & TECH 2013-08-07 CN disclosed
EP-1773791-B1 PYRROLOTRIAZINE COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2010-09-22 EP disclosed
EP-1773791-B1 PYRROLOTRIAZINE COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2010-09-22 EP disclosed
EP-1773791-A4 PYRROLOTRIAZINE COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2009-08-26 EP disclosed
CN-101460198-A Thermosensitive polyphosphazene-bioactive molecule conjugate, preparation method and application thereof KOREA INST SCI & TECH (KR) 2009-06-17 CN disclosed
EP-1773791-A1 PYRROLOTRIAZINE COMPOUNDS Bristol-Myers Squibb Company (US) 2007-04-18 EP disclosed
US-7102003-B2 Pyrrolotriazine compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2006-09-05 US disclosed
WO-2006007468-A1 PYRROLOTRIAZINE COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY (US) 2006-01-19 WO disclosed
US-20060014745-A1 Pyrrolotriazine compounds BRISTOL-MYERS SQUIBB COMPANY 2006-01-19 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-20060014745-A1 Pyrrolotriazine compounds ERBB2, ERBB4, EGFR SMN1; SMN2 4694/4885DHFR 519/4885TSHR 378/4885

“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.