SCHEMBL17624238

SCHEMBL17624238

CS(=O)(=O)c1cncc(-c2ccc3c(n2)N(C(=O)Nc2ccccn2)[C@H]2CCN3C2)c1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PIK3C3 Q8NEB9 8/20 0.41
▸ ATR Q13535 1/20 0.37
▸ NPC1 O15118 2/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ GSK3B P49841 1/20 0.34
▸ DYRK1A Q13627 1/20 0.34
▸ RXFP1 Q9HBX9 1/20 0.34
▸ PIM1 P11309 1/20 0.34
▸ PIK3CA P42336 1/20 0.34
▸ MTOR P42345 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ KIF18A Q8NI77 1/20 0.34
▸ PTPN11 Q06124 1/20 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
SCHEMBL17618606 0.95 PIK3C3 (0.40) PIK3C3ATRNPC1RAB9ALMNA
SCHEMBL17618573 0.90 ATR (0.45) ATRNPC1RAB9ALMNATSHR
SCHEMBL17618562 0.89 PRMT5 (0.39) GSK3BDYRK1APIK3CAPTPN11
SCHEMBL17618539 0.87 CNR2 (0.39) GSK3BDYRK1A
SCHEMBL17618605 0.87 GSK3B (0.38) GSK3BDYRK1A
SCHEMBL17618609 0.87 PIK3C3 (0.41) PIK3C3GSK3BDYRK1APIM1
SCHEMBL17618596 0.87 DYRK1A (0.41) NPC1RAB9AGSK3BDYRK1APIK3CA
SCHEMBL17618610 0.86 PIK3C3 (0.38) PIK3C3ATRPIM1PIK3CAMTOR
SCHEMBL19365403 0.86 PIK3C3 (0.42) PIK3C3ATRNPC1RAB9ALMNA
SCHEMBL17618604 0.86 FAAH (0.37) GSK3BDYRK1A

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 5 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-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-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 PIK3C3 4732/4885ATR 1768/4885NPC1 3776/4885
US-20170355697-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS SIRT1, SIRT3, SIRT2 PIK3C3 4778/4885ATR 1867/4885NPC1 3380/4885
US-10590135-B2 Substituted bridged urea analogs as sirtuin modulators SIRT1, SIRT3, SIRT2 PIK3C3 4778/4885ATR 1867/4885NPC1 3380/4885

“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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