SCHEMBL17618695

SCHEMBL17618695

Cc1cc(-c2ccc3c(n2)N(C(=O)Nc2cnn(C)c2)[C@H]2CCN3C2)ccn1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 3/20 0.39
▸ JAK2 O60674 14/20 0.38
▸ JAK1 P23458 14/20 0.38
▸ TYK2 P29597 14/20 0.38
▸ JAK3 P52333 5/20 0.36
▸ WNT3A P56704 2/20 0.36
▸ CLK2 P49760 1/20 0.36
▸ LRRK2 Q5S007 1/20 0.36
▸ KDR P35968 1/20 0.36

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
SCHEMBL16754281 0.95 JAK2 (0.39) BTKJAK2JAK1TYK2JAK3
SCHEMBL19706754 0.90 DYRK1A (0.39) CLK2LRRK2
SCHEMBL17778667 0.90 DYRK1A (0.39) CLK2LRRK2
SCHEMBL16754671 0.90 HRH3 (0.38) WNT3A
SCHEMBL17778914 0.90 DYRK1A (0.43) CLK2
SCHEMBL16776500 0.90 BTK (0.37) BTKJAK2JAK1TYK2WNT3A
SCHEMBL16754297 0.89 WNT3A (0.43) WNT3A
SCHEMBL17768108 0.89 WNT3A (0.43) WNT3A
SCHEMBL17778671 0.89 EGFR (0.43) BTKJAK2JAK1TYK2CLK2
SCHEMBL16754500 0.88 IRAK4 (0.37) JAK3WNT3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10590135-B2 Substituted bridged urea analogs as sirtuin modulators GLAXOSMITHKLINE LLC (US) 2020-03-17 — — US disclosed
US-20170355697-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE LLC 2017-12-14 — — US disclosed
US-20170355697-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE LLC 2017-12-14 — — US disclosed
US-9834558-B2 Substituted bridged urea analogs as sirtuin modulators GLAXOSMITHKLINE LLC (US) 2017-12-05 — — US disclosed
US-9834558-B2 Substituted bridged urea analogs as sirtuin modulators GLAXOSMITHKLINE LLC (US) 2017-12-05 — — US disclosed
US-9765075-B2 Substituted bridged urea analogs as sirtuin modulators GLAXOSMITHKLINE LLC (US) 2017-09-19 — — US disclosed
US-9765075-B2 Substituted bridged urea analogs as sirtuin modulators GLAXOSMITHKLINE LLC (US) 2017-09-19 — — US disclosed
US-20160083386-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE LLC 2016-03-24 — — US disclosed
US-20160083386-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE LLC 2016-03-24 — — 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 (3 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-20160083386-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS SIRT1, SIRT3, SIRT2 BTK 706/4885JAK2 2409/4885JAK1 3270/4885
US-20170355697-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS SIRT1, SIRT3, SIRT2 BTK 678/4885JAK2 2392/4885JAK1 3366/4885
US-10590135-B2 Substituted bridged urea analogs as sirtuin modulators SIRT1, SIRT3, SIRT2 BTK 678/4885JAK2 2392/4885JAK1 3366/4885

“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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