SCHEMBL19706757

SCHEMBL19706757

Cc1cc(-c2ccc3c(n2)N(C(=O)Nc2nccc(Cl)n2)C2CCN3C2)ccn1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ IRAK4 Q9NWZ3 10/20 0.34
▸ USP30 Q70CQ3 3/20 0.33
▸ WNT3A P56704 3/20 0.33
▸ ABL1 P00519 1/20 0.33
▸ CCNC P24863 1/20 0.33
▸ CDK8 P49336 1/20 0.33
▸ MAP4K4 O95819 1/20 0.32
▸ MAPK1 P28482 1/20 0.32

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
SCHEMBL17768050 1.00 IRAK4 (0.34) IRAK4USP30WNT3AABL1CCNC
SCHEMBL17778384 0.92 L3MBTL1 (0.35) IRAK4USP30WNT3AABL1MAP4K4
SCHEMBL16754615 0.92 L3MBTL1 (0.35) IRAK4USP30WNT3AABL1MAP4K4
SCHEMBL16754671 0.87 HRH3 (0.38) USP30WNT3AABL1
SCHEMBL17778671 0.86 EGFR (0.43) IRAK4
SCHEMBL16754395 0.86 IRAK4 (0.34) IRAK4USP30WNT3AABL1MAPK1
SCHEMBL19706758 0.85 GSK3B (0.35) IRAK4USP30WNT3A
SCHEMBL17778751 0.85 GSK3B (0.35) IRAK4USP30WNT3A
SCHEMBL17618685 0.85 WNT3A (0.36) USP30WNT3AABL1
SCHEMBL16754667 0.84 USP30 (0.36) IRAK4USP30WNT3AABL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170355705-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2017-12-14 — — 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 (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-20170355705-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS SIRT1, SIRT3, SIRT2 IRAK4 2889/4885USP30 189/4885WNT3A 4482/4885

“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.

Send feedback