SCHEMBL13744784

SCHEMBL13744784

CC1CCN(C(=O)c2ccccn2)CC1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.73
EPHX2 P34913 3/20 0.61
ACHE P22303 1/20 0.59
RBP4 P02753 1/20 0.58
HSD11B1 P28845 1/20 0.55
CHRNB2 P17787 1/20 0.55
CHRNB4 P30926 1/20 0.55
CHRNA3 P32297 1/20 0.55
CHRNA7 P36544 1/20 0.55
CHRNA4 P43681 1/20 0.55
EPHX1 P07099 2/20 0.53
RIPK1 Q13546 1/20 0.53
SMN1; SMN2 Q16637 3/20 0.52
NPC1 O15118 3/20 0.52
RAB9A P51151 3/20 0.52
ALDH1A1 P00352 2/20 0.52
TP53 P04637 1/20 0.52
HPGD P15428 1/20 0.52
NFKB1 P19838 1/20 0.52
NFKB2 Q00653 1/20 0.52

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
SCHEMBL14197785 0.91 L3MBTL1 (0.64) L3MBTL1EPHX2ACHERBP4HSD11B1
SCHEMBL22972208 0.86 L3MBTL1 (0.75) L3MBTL1EPHX2RBP4CHRNB2CHRNB4
SCHEMBL13629837 0.85 L3MBTL1 (0.69) L3MBTL1EPHX2RBP4CHRNB2CHRNB4
SCHEMBL7943306 0.85 L3MBTL1 (1.00) L3MBTL1EPHX2RBP4CHRNB2CHRNB4
SCHEMBL20690378 0.84 L3MBTL1 (0.67) L3MBTL1EPHX2RBP4CHRNB2CHRNB4
SCHEMBL16003044 0.84 EPHX2 (0.68) L3MBTL1EPHX2RBP4CHRNB2CHRNB4
SCHEMBL14730857 0.82 RECQL (0.62) L3MBTL1EPHX2CHRNB2CHRNB4CHRNA3
SCHEMBL18567189 0.82 L3MBTL1 (0.64) L3MBTL1EPHX2RBP4CHRNB2CHRNB4
SCHEMBL28467307 0.82 L3MBTL1 (0.69) L3MBTL1EPHX2RBP4CHRNB2CHRNB4
SCHEMBL2224365 0.82 L3MBTL1 (0.69) L3MBTL1EPHX2RBP4CHRNB2CHRNB4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9181183-B2 Prostaglandin D synthase inhibitory piperidine compounds TAIHO PHARMACEUTICAL CO., LTD. (JP) 2015-11-10 US disclosed
US-9181183-B2 Prostaglandin D synthase inhibitory piperidine compounds TAIHO PHARMACEUTICAL CO., LTD. (JP) 2015-11-10 US disclosed
US-20130165438-A1 PROSTAGLANDIN D SYNTHASE INHIBITORY PIPERIDINE COMPOUNDS TAIHO PHARMACEUTICAL CO., LTD. (JP) 2013-06-27 US disclosed
US-20130165438-A1 PROSTAGLANDIN D SYNTHASE INHIBITORY PIPERIDINE COMPOUNDS TAIHO PHARMACEUTICAL CO., LTD. (JP) 2013-06-27 US disclosed
US-20090209511-A1 Benzofuran Derivatives KAWAGUCHI TAKAYUKI 2009-08-20 US disclosed
US-20090209511-A1 Benzofuran Derivatives KAWAGUCHI TAKAYUKI 2009-08-20 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-20130165438-A1 PROSTAGLANDIN D SYNTHASE INHIBITORY PIPERIDINE COMPOUNDS PTGIS, PTGS1, PTGDR L3MBTL1 4781/4885EPHX2 255/4885ACHE 1060/4885
US-20090209511-A1 Benzofuran Derivatives F12, F2, F3 L3MBTL1 4101/4885EPHX2 2881/4885ACHE 3879/4885

“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.