SCHEMBL17769355

SCHEMBL17769355

COC(=O)CCC1Nc2nc(Cl)cc(C)c2NC1=O

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 3/20 0.37
SIRT2 Q8IXJ6 2/20 0.36
ADAMTS5 Q9UNA0 2/20 0.34
TP53 P04637 2/20 0.33
EGFR P00533 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MEN1 O00255 1/20 0.33
USP2 O75604 1/20 0.33
KMT2A Q03164 1/20 0.33
MAPT P10636 1/20 0.33
NOD2 Q9HC29 5/20 0.33
NOD1 Q9Y239 4/20 0.33

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
SCHEMBL17769353 1.00 ADAM17 (0.37) ADAM17SIRT2ADAMTS5TP53EGFR
SCHEMBL17769626 0.91 KAT2B (0.34) ADAM17ADAMTS5TP53L3MBTL1MEN1
SCHEMBL16754288 0.88 GAA (0.39) TP53MEN1USP2KMT2AMAPT
SCHEMBL16754286 0.88 GAA (0.39) TP53MEN1USP2KMT2AMAPT
SCHEMBL19736377 0.84 HSP90AA1 (0.34) MAPT
SCHEMBL19736379 0.84 HSP90AA1 (0.34) MAPT
SCHEMBL17769793 0.82 GAA (0.33) ADAM17SIRT2ADAMTS5L3MBTL1MAPT
SCHEMBL17769457 0.82 GAA (0.33) ADAM17SIRT2ADAMTS5L3MBTL1MAPT
SCHEMBL28387027 0.81 MAPT (0.36) TP53MEN1USP2KMT2AMAPT
SCHEMBL28387025 0.81 MAPT (0.36) TP53MEN1USP2KMT2AMAPT

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-20190048016-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE IP NO 2 LTD (GB) 2019-02-14 US disclosed
US-20190048016-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE IP NO 2 LTD (GB) 2019-02-14 US disclosed
EP-3221322-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS Glaxosmithkline Intellectual Property (No. 2) Limited (GB) 2017-09-27 EP disclosed
WO-2016079711-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2016-05-26 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-20190048016-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS SIRT1, SIRT3, SIRT2 ADAM17 3376/4885SIRT2 3/4885ADAMTS5 2759/4885

“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.