SCHEMBL19706063

SCHEMBL19706063

O=C(Nc1cnccn1)N1c2nc(-c3ccc(Cl)c(Cl)c3)ccc2C2CCC21

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SIRT2 Q8IXJ6 1/20 0.37
▸ ABL1 P00519 4/20 0.37
▸ KDM4E B2RXH2 5/20 0.36
▸ KMT2A Q03164 3/20 0.36
▸ POLB P06746 2/20 0.36
▸ RAB9A P51151 2/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ MAPT P10636 1/20 0.36
▸ GSK3B P49841 2/20 0.35
▸ DYRK1A Q13627 2/20 0.35
▸ KCNH2 Q12809 1/20 0.34
▸ FAAH O00519 1/20 0.34
▸ CHEK1 O14757 1/20 0.34

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
SCHEMBL19365563 0.84 KMT2A (0.37) SIRT2KDM4EKMT2APOLBRAB9A
SCHEMBL19365723 0.80 DYRK1A (0.38) ABL1KMT2AGSK3BDYRK1AFAAH
SCHEMBL19365318 0.80 ALOX15 (0.46) SIRT2MAPTGSK3BDYRK1AFAAH
SCHEMBL19365767 0.80 SIRT2 (0.36) SIRT2ABL1GSK3BDYRK1AFAAH
SCHEMBL19670235 0.79 GSK3B (0.36) SIRT2ABL1KDM4EKMT2APOLB
SCHEMBL19706220 0.79 MAP3K5 (0.35) KDM4ERAB9AGSK3BDYRK1AFAAH
SCHEMBL17618678 0.78 KMO (0.36) SIRT2ABL1KDM4EKMT2APOLB
SCHEMBL19706131 0.76 POLB (0.42) SIRT2KDM4EKMT2APOLBRAB9A
SCHEMBL19670621 0.76 SIRT2 (0.36) SIRT2ABL1KMT2AMEN1GSK3B
SCHEMBL19670416 0.75 GRM5 (0.38) —

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 SIRT2 3/4885ABL1 4089/4885KDM4E 950/4885
US-10590135-B2 Substituted bridged urea analogs as sirtuin modulators SIRT1, SIRT3, SIRT2 SIRT2 3/4885ABL1 4089/4885KDM4E 950/4885

“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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