SCHEMBL19703416

SCHEMBL19703416

C/N=C\c1cccc(-c2ccc3c(n2)N(C(=O)Nc2ccccn2)[C@H]2CCN3C2)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 1/20 0.35
▸ GSK3B P49841 1/20 0.35
▸ DYRK1A Q13627 1/20 0.35
▸ FAAH O00519 1/20 0.35
▸ VCP P55072 1/20 0.34
▸ BTK Q06187 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ SCN9A Q15858 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ FGFR4 P22455 1/20 0.33
▸ TRPV1 Q8NER1 1/20 0.33
▸ SIRT2 Q8IXJ6 1/20 0.33
▸ TP53BP1 Q12888 2/20 0.33
▸ BACE1 P56817 1/20 0.33
▸ PTGS1 P23219 1/20 0.33
▸ PTGS2 P35354 1/20 0.33
▸ MAP3K12 Q12852 1/20 0.32
▸ PTPN11 Q06124 1/20 0.32
▸ LMNA P02545 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
SCHEMBL19365385 1.00 CNR2 (0.35) CNR2GSK3BDYRK1AFAAHVCP
SCHEMBL19365358 0.92 FAAH (0.35) FAAH
SCHEMBL19670259 0.92 FAAH (0.35) GSK3BDYRK1AFAAHMEN1KMT2A
SCHEMBL19706066 0.92 FAAH (0.35) GSK3BDYRK1AFAAHMEN1KMT2A
SCHEMBL19365346 0.89 SCD (0.37) VCPBTKALDH1A1FGFR4
SCHEMBL19706030 0.89 SCD (0.37) VCPBTKALDH1A1FGFR4
SCHEMBL19670254 0.88 NEK2 (0.34) DYRK1ATP53BP1
SCHEMBL19706239 0.88 BTK (0.34) GSK3BDYRK1AFAAHBTKMEN1
SCHEMBL16775782 0.88 GRM5 (0.39) CNR2GSK3BDYRK1AFAAHVCP
SCHEMBL19670173 0.88 NPC1 (0.32) DYRK1A

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 2 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-20170355697-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS SIRT1, SIRT3, SIRT2 CNR2 2514/4885GSK3B 1728/4885DYRK1A 2623/4885
US-10590135-B2 Substituted bridged urea analogs as sirtuin modulators SIRT1, SIRT3, SIRT2 CNR2 2514/4885GSK3B 1728/4885DYRK1A 2623/4885

“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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