SCHEMBL4911375

SCHEMBL4911375

Cc1cc(/N=N/c2ccc(S(=O)(=O)Nc3ccccn3)cc2)cc(C(=O)O)c1O

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 17/20 0.82
BRD3 Q15059 4/20 0.82
CREBBP Q92793 4/20 0.82
BRD7 Q9NPI1 2/20 0.82
MEN1 O00255 1/20 0.76
ABCC3 O15438 1/20 0.76
ABCC4 O15439 1/20 0.76
USP2 O75604 1/20 0.76
SLCO2B1 O94956 1/20 0.76
ALDH1A1 P00352 1/20 0.76
CA1 P00915 1/20 0.76
CA2 P00918 1/20 0.76
LMNA P02545 1/20 0.76
MMP1 P03956 1/20 0.76
ABCB1 P08183 1/20 0.76
MAPT P10636 1/20 0.76
CYP2C9 P11712 1/20 0.76
HPGD P15428 1/20 0.76
TSHR P16473 1/20 0.76
NFKB1 P19838 1/20 0.76

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
SCHEMBL4911386 1.00 BRD4 (0.82) BRD4BRD3CREBBPBRD7MEN1
SCHEMBL15496579 0.90 BRD4 (1.00) BRD4BRD3CREBBPBRD7BAZ2B
SCHEMBL15951446 0.89 SLC7A11 (0.78) BRD4BRD3CREBBPBRD7MEN1
SCHEMBL12763634 0.89 SLC7A11 (0.78) BRD4BRD3CREBBPBRD7MEN1
Sulfasalazine SCHEMBL487664 0.86 SLC7A11 (1.00) BRD4BRD3CREBBPBRD7MEN1
Sulfasalazine SCHEMBL10289061 0.86 SLC7A11 (1.00) BRD4BRD3CREBBPBRD7MEN1
Sulfasalazine SCHEMBL4514 0.86 SLC7A11 (1.00) BRD4BRD3CREBBPBRD7MEN1
Sulfasalazine SCHEMBL5664970 0.86 SLC7A11 (1.00) BRD4BRD3CREBBPBRD7MEN1
Sulfasalazine SCHEMBL4515 0.86 SLC7A11 (1.00) BRD4BRD3CREBBPBRD7MEN1
Sulfasalazine SCHEMBL31174674 0.86 SLC7A11 (1.00) BRD4BRD3CREBBPBRD7MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080090788-A1 Chemical Compounds UNIVERSITY OF SOUTHAMPTON (GB) 2008-04-17 US claimed
EP-1835900-A1 SULFASALAZINE ANALOGUES AS NF-KB INHIBITORS UNIVERSITY OF SOUTHAMPTON (GB) 2007-09-26 EP claimed
WO-2006072783-A1 SULFASALAZINE ANALOGUES AS NF-KB INHIBITORS UNIVERSITY OF SOUTHAMPTON (GB) 2006-07-13 WO claimed
US-20080090788-A1 Chemical Compounds UNIVERSITY OF SOUTHAMPTON (GB) 2008-04-17 US disclosed
US-20080090788-A1 Chemical Compounds UNIVERSITY OF SOUTHAMPTON (GB) 2008-04-17 US disclosed
US-20080090788-A1 Chemical Compounds UNIVERSITY OF SOUTHAMPTON (GB) 2008-04-17 US disclosed
EP-1835900-A1 SULFASALAZINE ANALOGUES AS NF-KB INHIBITORS UNIVERSITY OF SOUTHAMPTON (GB) 2007-09-26 EP disclosed
WO-2006072783-A1 SULFASALAZINE ANALOGUES AS NF-KB INHIBITORS UNIVERSITY OF SOUTHAMPTON (GB) 2006-07-13 WO 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-20080090788-A1 Chemical Compounds NFRKB, NFKB2, NFKBIA BRD4 445/4885BRD3 496/4885CREBBP 908/4885

“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.