SCHEMBL6095692

SCHEMBL6095692

COc1ccc(C(CC(=O)NO)N2Cc3ccccc3C2=O)cc1OC(C)C

nearest known ligand 0.69

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.63
MEN1 O00255 2/20 0.63
TP53 P04637 4/20 0.63
MAPT P10636 4/20 0.62
POLB P06746 1/20 0.55

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
SCHEMBL1193948 0.93 TP53 (0.70) KMT2AMEN1TP53MAPTPOLB
SCHEMBL6095455 0.90 MEN1 (0.60) KMT2AMEN1TP53MAPT
SCHEMBL825563 0.89 TP53 (0.71) KMT2AMEN1TP53MAPT
SCHEMBL6095731 0.89 TP53 (0.71) KMT2AMEN1TP53MAPT
SCHEMBL825613 0.86 PDE4A (0.63) KMT2AMEN1TP53MAPT
SCHEMBL14985953 0.85 TP53 (0.70) KMT2AMEN1TP53MAPTPOLB
SCHEMBL1193943 0.84 TNF (0.72)
SCHEMBL9988294 0.84 TP53 (0.69) KMT2AMEN1TP53MAPTPOLB
SCHEMBL7885470 0.83 TNF (0.69) KMT2AMEN1TP53MAPT
SCHEMBL9924689 0.83 TP53 (0.67) KMT2AMEN1TP53MAPT

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 6 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 disclosed
US-20040006096-A1 Substituted alkanohydroxamic acids and method of reducing TNFalpha levels CELGENE CORPORATION 2004-01-08 US disclosed
US-6656964-B2 Reducing levels of tumor necrosis factor alpha; inhibition of undesireable levels of matrix metalloproteinases CELGENE CORPORATION 2003-12-02 US disclosed
EP-1035848-B1 SUBSTITUTED ALKANOHYDROXAMIC ACIDS AND METHOD OF REDUCING TNF-ALPHA LEVELS CELGENE CORP (US) 2003-04-23 EP disclosed
US-20010049371-A1 Method of inhibiting phosphodiesterases with substituted alkanohydroxamic acids CALGENE CORPORATION 2001-12-06 US disclosed
US-6214857-B1 REDUCES TUMOR NECROSIS FACTOR LEVELS CELGENE CORPORATION 2001-04-10 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-20040006096-A1 Substituted alkanohydroxamic acids and method of reducing TNFalpha levels TNF, TNFRSF1A, LTA KMT2A 748/4885MEN1 4505/4885TP53 3755/4885
US-20010049371-A1 Method of inhibiting phosphodiesterases with substituted alkanohydroxamic acids PDE3A, PDE2A, PDE3B KMT2A 1390/4885MEN1 4191/4885TP53 4572/4885

“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.