SCHEMBL19670591

SCHEMBL19670591

CCN1CCCN(C(=O)Nc2ccccn2)c2nc(-c3ccnc(C)c3)ccc21

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ FGFR4 P22455 1/20 0.42
▸ WNT3A P56704 10/20 0.41
▸ GRM5 P41594 2/20 0.38
▸ FAAH O00519 1/20 0.36
▸ ADORA3 P0DMS8 1/20 0.36
▸ ADORA2A P29274 1/20 0.36
▸ CHRNA7 P36544 1/20 0.35
▸ CHRNA10 Q9GZZ6 1/20 0.35
▸ CHRNA9 Q9UGM1 1/20 0.35
▸ DNM1L O00429 1/20 0.35
▸ SIRT2 Q8IXJ6 1/20 0.35

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
SCHEMBL19670532 0.90 FAAH (0.41) WNT3AFAAHSIRT2
SCHEMBL19670569 0.89 FAAH (0.36) WNT3AFAAH
SCHEMBL19670124 0.89 WNT3A (0.40) WNT3AGRM5
SCHEMBL19670663 0.88 FGFR4 (0.40) FGFR4FAAHCHRNA7CHRNA10CHRNA9
SCHEMBL12654669 0.87 CNR2 (0.50) FGFR4GRM5FAAHADORA2ASIRT2
SCHEMBL19670352 0.85 HTR2C (0.47) —
SCHEMBL19365697 0.85 DYRK1A (0.40) —
SCHEMBL19670620 0.84 HTR2A (0.38) WNT3AGRM5
SCHEMBL19706092 0.84 CYP11B2 (0.37) WNT3AGRM5
SCHEMBL19670435 0.84 WNT3A (0.36) FGFR4WNT3AGRM5

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 4 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-20190048016-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE IP NO 2 LTD (GB) 2019-02-14 — — 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

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-20170355697-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS SIRT1, SIRT3, SIRT2 FGFR4 1754/4885WNT3A 4291/4885GRM5 3471/4885
US-20190048016-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS SIRT1, SIRT3, SIRT2 FGFR4 1926/4885WNT3A 4543/4885GRM5 3991/4885
US-10590135-B2 Substituted bridged urea analogs as sirtuin modulators SIRT1, SIRT3, SIRT2 FGFR4 1754/4885WNT3A 4291/4885GRM5 3471/4885

“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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