SCHEMBL907317

SCHEMBL907317

Cc1ccc(S(=O)(=O)OCCOCCOCCOCCOCCOCC(=O)Nc2ccc(N(S)C(=O)NC(=O)c3ccc(C(C)(C)C)cc3)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 2/20 0.48
CTDSP1 Q9GZU7 1/20 0.41
SIRT5 Q9NXA8 1/20 0.41
ENPP1 P22413 3/20 0.39
ENPP3 O14638 2/20 0.39
LMNA P02545 2/20 0.38
MAPT P10636 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
SIRT1 Q96EB6 5/20 0.37
POLB P06746 1/20 0.37
SIRT2 Q8IXJ6 1/20 0.37

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
SCHEMBL907315 0.85 STAT3 (0.53) STAT3LMNAMAPTMEN1KMT2A
SCHEMBL907200 0.83 SIRT1 (0.42) LMNAMAPTSIRT1POLBSIRT2
Hydrochloric Acid SCHEMBL907378 0.83 SIRT1 (0.52) SIRT1SIRT2
SCHEMBL3405827 0.83 MAPT (0.38) LMNAMAPTMEN1KMT2ACA1
SCHEMBL907439 0.73 SIRT1 (0.55) SIRT1SIRT2
SCHEMBL907583 0.72 NR1H4 (0.54) MAPTMEN1KMT2ACA1CA2
SCHEMBL907521 0.70 NAMPT (0.46) LMNAMAPTSIRT1
SCHEMBL907350 0.70 SIRT1 (0.70) SIRT1SIRT2
SCHEMBL3850008 0.69 EPHX2 (0.57) LMNAMAPTMEN1KMT2ASIRT1
SCHEMBL29665279 0.68 STAT3 (0.44) STAT3CTDSP1SIRT5ENPP1ENPP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8501991-B2 P53 activating compounds UNIVERSITY COURT OF THE UNIVERSITY OF DUNDEE (GB) 2013-08-06 US disclosed
US-20110021529-A1 P53 ACTIVATING COMPOUNDS UNIVERSITY COURT OF THE UNIVERSITY OF DUNDEE (GB) 2011-01-27 US disclosed
EP-2099445-A2 P53 ACTIVATING BENZOYL UREA AND BENZOYL THIOUREA COMPOUNDS University Court of The University of Dundee (GB) 2009-09-16 EP disclosed
WO-2008029096-A2 P53 ACTIVATING BENZOYL UREA AND BENZOYL THIOUREA COMPOUNDS UNIVERSITY COURT OF THE UNIVERSITY OF DUNDEE (GB) 2008-03-13 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-20110021529-A1 P53 ACTIVATING COMPOUNDS TP53, TP53BP1, SIRT1 STAT3 82/4885CTDSP1 1228/4885SIRT5 33/4885

“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.