SCHEMBL6097738

SCHEMBL6097738

COc1ccc(C(CC(=O)NO)N2C(=O)c3cccc(N)c3C2=O)cc1OC

nearest known ligand 0.83

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TNF P01375 14/20 0.83
PDE4A P27815 8/20 0.65
PDE4B Q07343 8/20 0.65
PDE4C Q08493 8/20 0.65
PDE4D Q08499 8/20 0.65

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
SCHEMBL825616 0.93 TNF (0.73) TNFPDE4APDE4BPDE4CPDE4D
SCHEMBL6691613 0.91 TNF (0.84) TNFPDE4APDE4BPDE4CPDE4D
SCHEMBL537257 0.91 TNF (0.84) TNFPDE4APDE4BPDE4CPDE4D
SCHEMBL6690298 0.90 TNF (0.83) TNFPDE4APDE4BPDE4CPDE4D
SCHEMBL1194027 0.89 TNF (0.83) TNFPDE4APDE4BPDE4CPDE4D
SCHEMBL6099727 0.89 PDE4A (0.70) TNFPDE4APDE4BPDE4CPDE4D
SCHEMBL4854783 0.87 PDE4A (0.70) TNFPDE4APDE4BPDE4CPDE4D
SCHEMBL6097184 0.85 TNF (0.72) TNFPDE4APDE4BPDE4CPDE4D
SCHEMBL21494496 0.84 TNF (0.87) TNFPDE4APDE4BPDE4CPDE4D
SCHEMBL21494520 0.84 TNF (0.87) TNFPDE4APDE4BPDE4CPDE4D

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
US-7091356-B2 Substituted alkanohydroxamic acids and method of reducing TNFα levels CELGENE CORPORATION 2006-08-15 US claimed
US-20040006096-A1 Substituted alkanohydroxamic acids and method of reducing TNFalpha levels CELGENE CORPORATION 2004-01-08 US claimed
US-6656964-B2 Reducing levels of tumor necrosis factor alpha; inhibition of undesireable levels of matrix metalloproteinases CELGENE CORPORATION 2003-12-02 US claimed
EP-1035848-B1 SUBSTITUTED ALKANOHYDROXAMIC ACIDS AND METHOD OF REDUCING TNF-ALPHA LEVELS CELGENE CORP (US) 2003-04-23 EP claimed
US-20010049371-A1 Method of inhibiting phosphodiesterases with substituted alkanohydroxamic acids CALGENE CORPORATION 2001-12-06 US claimed
EP-1035848-A4 SUBSTITUTED ALKANOHYDROXAMIC ACIDS AND METHOD OF REDUCING TNF-ALPHA LEVELS CELGENE CORP (US) 2001-05-23 EP claimed
US-6214857-B1 REDUCES TUMOR NECROSIS FACTOR LEVELS CELGENE CORPORATION 2001-04-10 US claimed
EP-1035848-A1 SUBSTITUTED ALKANOHYDROXAMIC ACIDS AND METHOD OF REDUCING TNF-ALPHA LEVELS CELGENE CORPORATION (US) 2000-09-20 EP claimed
WO-1999006041-A1 SUBSTITUTED ALKANOHYDROXAMIC ACIDS AND METHOD OF REDUCING TNFα LEVELS CELGENE CORPORATION (US) 1999-02-11 WO claimed

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-20040006096-A1 Substituted alkanohydroxamic acids and method of reducing TNFalpha levels TNF, TNFRSF1A, LTA TNF 1/4885PDE4A 10/4885PDE4B 54/4885
US-20010049371-A1 Method of inhibiting phosphodiesterases with substituted alkanohydroxamic acids PDE3A, PDE2A, PDE3B TNF 8/4885PDE4A 6/4885PDE4B 15/4885

“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.