SCHEMBL13745122

SCHEMBL13745122

C[C@H]1CC[C@H](CN2CCCC2=O)CC1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
PIK3CD O00329 1/20 0.46
TRPC5 Q9UL62 1/20 0.42
TSHR P16473 2/20 0.41
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
CHRM2 P08172 1/20 0.39
CHRM5 P08912 1/20 0.39
CYP2D6 P10635 1/20 0.39
CHRM1 P11229 1/20 0.39
ALOX12 P18054 1/20 0.39
NFKB1 P19838 1/20 0.39
CHRM3 P20309 1/20 0.39
APEX1 P27695 1/20 0.39
MAPK1 P28482 1/20 0.39
PMP22 Q01453 1/20 0.39
ACHE P22303 1/20 0.39
LTA4H P09960 2/20 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
SCHEMBL7384750 0.91 KDM4E (0.52) KDM4EL3MBTL1PIK3CDTSHRCHRM2
SCHEMBL14835319 0.85 L3MBTL1 (0.48) KDM4EL3MBTL1PIK3CDTSHRCHRM2
SCHEMBL4513010 0.83 KDM4E (0.47) KDM4EL3MBTL1PIK3CDTSHRCHRM2
SCHEMBL22340247 0.82 KDM4E (0.47) KDM4EL3MBTL1PIK3CDTSHRALDH1A1
SCHEMBL14820142 0.82 KDM4E (0.47) KDM4EL3MBTL1PIK3CDTSHRALDH1A1
SCHEMBL14835760 0.79 L3MBTL1 (0.44) KDM4EL3MBTL1PIK3CDTSHRCHRM2
SCHEMBL255185 0.79 KDM4E (0.44) KDM4EL3MBTL1PIK3CDTSHRLTA4H
SCHEMBL29779388 0.79 KDM4E (0.47) KDM4EL3MBTL1PIK3CDTSHRALDH1A1
SCHEMBL4740483 0.79 KDM4E (0.47) KDM4EL3MBTL1PIK3CDTSHRCHRM2
SCHEMBL14083463 0.78 KDM4E (0.44) KDM4EL3MBTL1PIK3CDTSHRALDH1A1

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-20090209511-A1 Benzofuran Derivatives KAWAGUCHI TAKAYUKI 2009-08-20 US disclosed
US-20090209511-A1 Benzofuran Derivatives KAWAGUCHI TAKAYUKI 2009-08-20 US disclosed
US-7262206-B2 Cycloalkyl—containing 5-acylindolinones, the preparation thereof and their use as medicaments BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-08-28 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-20090209511-A1 Benzofuran Derivatives F12, F2, F3 KDM4E 1464/4885L3MBTL1 4101/4885PIK3CD 4082/4885

“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.