SCHEMBL17768118

SCHEMBL17768118

Cc1cc(-c2ccc3c(n2)N(C(=O)Nc2cc(Cl)cnn2)[C@H]2CCN3C2)ccn1

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ WNT3A P56704 7/20 0.36
▸ MAPK1 P28482 6/20 0.35
▸ ABL1 P00519 1/20 0.35
▸ FAAH O00519 2/20 0.35
▸ USP30 Q70CQ3 2/20 0.33
▸ JAK3 P52333 2/20 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
SCHEMBL16754414 0.88 FAAH (0.43) WNT3AABL1FAAH
SCHEMBL19689662 0.87 GSK3B (0.39) WNT3AABL1
SCHEMBL17778675 0.86 DYRK1A (0.36) WNT3AMAPK1ABL1
SCHEMBL17770584 0.86 ABL1 (0.36) WNT3AMAPK1ABL1USP30JAK3
SCHEMBL16754305 0.86 ABL1 (0.36) WNT3AMAPK1ABL1USP30JAK3
SCHEMBL16238798 0.85 WNT3A (0.40) WNT3AABL1
SCHEMBL17618709 0.85 ABL1 (0.37) WNT3AMAPK1ABL1USP30JAK3
SCHEMBL19699129 0.85 WNT3A (0.41) WNT3AABL1
SCHEMBL17778385 0.85 WNT3A (0.40) WNT3AABL1
SCHEMBL16754278 0.85 WNT3A (0.40) WNT3AABL1

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-20170355705-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2017-12-14 — — US disclosed
US-20170355705-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2017-12-14 — — US disclosed
US-20170355705-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2017-12-14 — — US disclosed
EP-3221316-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS Glaxosmithkline Intellectual Property (No. 2) Limited (GB) 2017-09-27 — — EP disclosed
WO-2016079709-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2016-05-26 — — WO disclosed
WO-2016079709-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-20170355705-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS SIRT1, SIRT3, SIRT2 WNT3A 4482/4885MAPK1 1307/4885ABL1 3898/4885

“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.

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