SCHEMBL10201410

SCHEMBL10201410

CCCCNc1nc(CNC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(F)cc2)cc(-c2ccc3c(c2)OCO3)n1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.52
TRPA1 O75762 7/20 0.51
LMNA P02545 1/20 0.50
ATM Q13315 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.45
KCNQ1 P51787 1/20 0.44
FKBP1A P62942 1/20 0.44
TDP1 Q9NUW8 1/20 0.43
TSHR P16473 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL10201935 0.90 MAPT (0.53) MAPTTRPA1LMNAATMSMN1; SMN2
SCHEMBL10203365 0.88 LMNA (0.57) MAPTTRPA1LMNAATMSMN1; SMN2
SCHEMBL893502 0.88 TRPA1 (0.54) MAPTTRPA1LMNAATMSMN1; SMN2
SCHEMBL10203330 0.88 TRPA1 (0.50) MAPTTRPA1LMNAATMSMN1; SMN2
SCHEMBL10202123 0.88 TRPA1 (0.48) MAPTTRPA1LMNAATMSMN1; SMN2
SCHEMBL10203366 0.87 LMNA (0.55) MAPTTRPA1LMNAATMSMN1; SMN2
SCHEMBL893080 0.87 TRPA1 (0.65) TRPA1ATMSMN1; SMN2KCNQ1
SCHEMBL10202101 0.86 TSHR (0.61) MAPTTRPA1LMNAATMSMN1; SMN2
SCHEMBL10202170 0.85 LMNA (0.54) MAPTTRPA1LMNAATMSMN1; SMN2
SCHEMBL10202125 0.85 MAPT (0.51) MAPTTRPA1LMNAATMKCNQ1

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 MAPT 1004/4885TRPA1 1/4885LMNA 4619/4885

“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.