SCHEMBL19865054

SCHEMBL19865054

Cc1ccc(C(C)C)cc1N1CCC(C(F)(F)F)C1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ACACB O00763 3/20 0.41
TRPV3 Q8NET8 1/20 0.36
LMNA P02545 2/20 0.36
C5AR1 P21730 11/20 0.35
TRPA1 O75762 1/20 0.35
PTGS1 P23219 1/20 0.35
CACNA1C Q13936 1/20 0.35
NOTUM Q6P988 1/20 0.34
MAP4K4 O95819 1/20 0.34
MAPT P10636 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
SCHEMBL19862434 0.86 ACACB (0.40) ACACBLMNAC5AR1TRPA1PTGS1
SCHEMBL19862435 0.80 LMNA (0.40) ACACBLMNAC5AR1TRPA1PTGS1
SCHEMBL17618323 0.77 NOTUM (0.59) ACACBTRPV3NOTUM
SCHEMBL19365627 0.75 MAP4K4 (0.44) ACACBTRPV3MAP4K4
SCHEMBL12074844 0.73 LMNA (0.52) LMNAC5AR1TRPA1PTGS1CACNA1C
SCHEMBL15187982 0.72 HRH3 (0.46) TRPV3LMNAMAPT
SCHEMBL16939771 0.70 LMNA (0.44) LMNAC5AR1TRPA1PTGS1CACNA1C
SCHEMBL22422339 0.69 ADRB1 (0.54) LMNA
SCHEMBL14228296 0.69 LMNA (0.46) LMNATRPA1PTGS1CACNA1CMAPT
SCHEMBL12257599 0.69 HTT (0.42) ACACBNOTUM

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180044338-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE LLC (US) 2018-02-15 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 (1 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-20180044338-A1 SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS SIRT1, SIRT3, SIRT2 ACACB 344/4885TRPV3 4464/4885LMNA 3671/4885

“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.