SCHEMBL19670523

SCHEMBL19670523

CCN1CCCN(C(=O)Nc2cnccn2)c2nc(N3CCCC(C(F)(F)F)C3)ccc21

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TRPV3 Q8NET8 1/20 0.38
▸ POLB P06746 1/20 0.37
▸ MAP4K4 O95819 1/20 0.37
▸ EIF2AK4 Q9P2K8 1/20 0.36
▸ SCN10A Q9Y5Y9 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ KMT2A Q03164 4/20 0.35
▸ ATM Q13315 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ MTOR P42345 1/20 0.34
▸ NAMPT P43490 1/20 0.34
▸ ACACB O00763 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
SCHEMBL19706161 1.00 TRPV3 (0.38) TRPV3POLBMAP4K4EIF2AK4SCN10A
SCHEMBL19706102 0.91 FGFR4 (0.40) TRPV3MAP4K4EIF2AK4SCN10AMTOR
SCHEMBL19670324 0.89 MAP4K4 (0.39) TRPV3MAP4K4EIF2AK4SCN10AACACB
SCHEMBL19706164 0.88 FGFR4 (0.40) TRPV3MAP4K4EIF2AK4SCN10A
SCHEMBL19670376 0.88 ALDH1A1 (0.41) TRPV3NAMPT
SCHEMBL19706197 0.88 DEGS1 (0.39) TRPV3MAP4K4EIF2AK4SCN10A
SCHEMBL19706272 0.87 TRPV3 (0.40) TRPV3MAP4K4EIF2AK4SCN10AACACB
SCHEMBL19670545 0.87 FGFR4 (0.40) TRPV3MAP4K4SCN10AKMT2ANPC1
SCHEMBL19706295 0.87 FGFR4 (0.40) TRPV3MAP4K4SCN10AKMT2ANPC1
SCHEMBL16785626 0.82 POLB (0.39) TRPV3POLBMAP4K4EIF2AK4SCN10A

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 3 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

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 TRPV3 4093/4885POLB 961/4885MAP4K4 2229/4885
US-10590135-B2 Substituted bridged urea analogs as sirtuin modulators SIRT1, SIRT3, SIRT2 TRPV3 4093/4885POLB 961/4885MAP4K4 2229/4885

“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.

Send feedback