SCHEMBL10201448

SCHEMBL10201448

CN1CCN(C(=O)c2ccc(Nc3nc(CNC(=O)[C@@H]4CCCN4S(=O)(=O)c4ccc(F)cc4)cc(-c4ccc5c(c4)OCO5)n3)cc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.49
MAPT P10636 1/20 0.48
TRPA1 O75762 8/20 0.47
ATM Q13315 1/20 0.43
ALDH1A1 P00352 3/20 0.42
TSHR P16473 2/20 0.42
KCNQ1 P51787 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL10203365 0.92 LMNA (0.57) LMNAMAPTTRPA1ATMALDH1A1
SCHEMBL10202170 0.88 LMNA (0.54) LMNAMAPTTRPA1ATMALDH1A1
SCHEMBL10202173 0.88 KCNQ1 (0.54) LMNAMAPTTRPA1ATMTSHR
SCHEMBL10203366 0.84 LMNA (0.55) LMNAMAPTTRPA1ATMALDH1A1
SCHEMBL10201942 0.84 LMNA (0.50) LMNAMAPTTRPA1ATMALDH1A1
SCHEMBL10201935 0.82 MAPT (0.53) LMNAMAPTTRPA1ATMTSHR
SCHEMBL10201410 0.82 MAPT (0.52) LMNAMAPTTRPA1ATMTSHR
SCHEMBL10202125 0.80 MAPT (0.51) LMNAMAPTTRPA1ATMALDH1A1
SCHEMBL10202101 0.80 TSHR (0.61) LMNAMAPTTRPA1ATMALDH1A1
SCHEMBL10201961 0.79 MAPT (0.54) LMNAMAPTTRPA1ATMTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120083474-A1 HETEROCYCLIC AMIDES AS MODULATORS OF TRPA1 JANSSEN PHARMACEUTICA NV (BE) 2012-04-05 US disclosed
WO-2010141805-A1 HETEROCYCLIC AMIDES AS MODULATORS OF TRPA1 JANSSEN PHARMACEUTICA NV (BE) 2010-12-09 WO 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-20120083474-A1 HETEROCYCLIC AMIDES AS MODULATORS OF TRPA1 TRPA1, TRPV1, TRPV2 LMNA 4619/4885MAPT 1004/4885TRPA1 1/4885

“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.