SCHEMBL19365685

SCHEMBL19365685

O=C(Nc1cccnc1)N1c2nc(N3CCCC(C(F)(F)F)C3)ccc2C2CCCC21

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 2/20 0.38
▸ TRPV3 Q8NET8 1/20 0.38
▸ TRPV1 Q8NER1 1/20 0.38
▸ BTK Q06187 1/20 0.37
▸ MAP4K4 O95819 1/20 0.37
▸ TRPM8 Q7Z2W7 1/20 0.36
▸ EIF2AK4 Q9P2K8 1/20 0.36
▸ SCN10A Q9Y5Y9 1/20 0.36
▸ FAAH O00519 1/20 0.36
▸ POLB P06746 2/20 0.36
▸ HTR2A P28223 2/20 0.35
▸ HTR2C P28335 2/20 0.35
▸ KMT2A Q03164 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
SCHEMBL19365687 0.90 TRPV3 (0.40) NAMPTTRPV3TRPV1MAP4K4TRPM8
SCHEMBL19364857 0.88 TRPV3 (0.40) NAMPTTRPV3BTKMAP4K4EIF2AK4
SCHEMBL19364859 0.87 TRPV3 (0.39) TRPV3MAP4K4EIF2AK4SCN10AKMT2A
SCHEMBL19365455 0.87 POLB (0.39) TRPV3MAP4K4EIF2AK4SCN10APOLB
SCHEMBL19365689 0.86 MAP4K4 (0.41) NAMPTTRPV3MAP4K4EIF2AK4SCN10A
SCHEMBL19670298 0.86 BTK (0.40) NAMPTTRPV3TRPV1BTKMAP4K4
SCHEMBL19364923 0.85 SCN10A (0.41) TRPV3BTKMAP4K4SCN10APOLB
SCHEMBL19365534 0.85 DGAT2 (0.41) NAMPTTRPV3TRPV1BTKMAP4K4
SCHEMBL19365683 0.84 RHOA (0.46) TRPV3SCN10A
SCHEMBL19365397 0.84 MAP4K4 (0.41) TRPV3MAP4K4EIF2AK4SCN10AFAAH

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-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

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 NAMPT 74/4885TRPV3 4093/4885TRPV1 3670/4885
US-10590135-B2 Substituted bridged urea analogs as sirtuin modulators SIRT1, SIRT3, SIRT2 NAMPT 74/4885TRPV3 4093/4885TRPV1 3670/4885

“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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