SCHEMBL893796

SCHEMBL893796

CC(C)(C)OC(=O)N1CCCC1C(=O)NCc1cc(Cl)ccn1

nearest known ligand 0.69

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.69
LMNA P02545 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
USP30 Q70CQ3 3/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
NPC1 O15118 1/20 0.49
POLB P06746 2/20 0.47
SCN5A Q14524 1/20 0.47
SCN3A Q9NY46 1/20 0.47
F2 P00734 6/20 0.47
UCHL1 P09936 1/20 0.47
KDM4E B2RXH2 2/20 0.47
F10 P00742 1/20 0.47
PRSS1 P07477 1/20 0.47
PRSS2 P07478 1/20 0.47
PRSS3 P35030 1/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46

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
SCHEMBL10203304 1.00 ALDH1A1 (0.69) ALDH1A1LMNANPSR1USP30L3MBTL1
SCHEMBL7468280 0.85 ALDH1A1 (0.59) ALDH1A1LMNANPSR1USP30L3MBTL1
SCHEMBL894253 0.83 ALDH1A1 (0.53) ALDH1A1LMNANPSR1USP30L3MBTL1
SCHEMBL7307776 0.82 ALDH1A1 (0.72) ALDH1A1LMNANPSR1USP30SMN1; SMN2
SCHEMBL893922 0.82 ALDH1A1 (0.47) ALDH1A1
SCHEMBL10201912 0.82 ALDH1A1 (0.47) ALDH1A1
SCHEMBL13374829 0.81 ALDH1A1 (0.74) ALDH1A1LMNANPSR1SMN1; SMN2NPC1
SCHEMBL13045904 0.81 ALDH1A1 (0.51) ALDH1A1LMNANPSR1USP30L3MBTL1
SCHEMBL10203302 0.80 ALDH1A1 (0.45) ALDH1A1POLBF2PRSS1
SCHEMBL893785 0.80 ALDH1A1 (0.45) ALDH1A1POLBF2PRSS1

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-8614201-B2 Heterocyclic amides as modulators of TRPA1 JANSSEN PHARMACEUTICA NV (BE) 2013-12-24 US disclosed
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 ALDH1A1 1469/4885LMNA 4619/4885NPSR1 641/4885

“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.