SCHEMBL291850

SCHEMBL291850

CC1(C)CN(c2cccc(F)c2)C(=O)CN1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.49
OPRL1 P41146 1/20 0.49
ALDH1A1 P00352 2/20 0.44
POLB P06746 2/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
AR P10275 1/20 0.42
HSD11B1 P28845 1/20 0.41
FAAH O00519 1/20 0.41
MGLL Q99685 1/20 0.41
ALOX5 P09917 2/20 0.40
SLC6A2 P23975 2/20 0.39
SLC6A4 P31645 2/20 0.39
SLC6A3 Q01959 2/20 0.39
PGR P06401 1/20 0.39
FADS1 O60427 1/20 0.39
DOCK5 Q9H7D0 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
SCHEMBL293198 0.85 AR (0.40) OPRM1OPRL1ARALOX5SLC6A2
SCHEMBL291532 0.84 KMT2A (0.50) ALDH1A1GAAMAPTMEN1KMT2A
SCHEMBL291894 0.83 MAPT (0.43) OPRM1ALDH1A1POLBGAAMAPT
SCHEMBL292131 0.82 AR (0.43) POLBGAAMEN1KMT2AAR
SCHEMBL292596 0.82 MAPT (0.50) POLBMAPTMGLLALOX5
SCHEMBL292402 0.78 AR (0.39) OPRM1OPRL1GAAMEN1KMT2A
SCHEMBL291498 0.77 AR (0.42) OPRM1OPRL1MEN1KMT2AL3MBTL1
SCHEMBL292608 0.77 AR (0.39) OPRM1OPRL1ALDH1A1ARHSD11B1
SCHEMBL292828 0.76 HTR7 (0.40) AR
SCHEMBL291908 0.76 HTR7 (0.40) OPRM1GAAMAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8158790-B2 Cyclic amine compound DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-04-17 US disclosed
EP-2036896-B1 CYCLIC AMINE COMPOUND DAIICHI SANKYO CO LTD (JP) 2012-03-14 EP disclosed
US-20090286807-A1 CYCLIC AMINE COMPOUND DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-11-19 US disclosed
EP-2036896-A1 CYCLIC AMINE COMPOUND Daiichi Sankyo Company, Limited (JP) 2009-03-18 EP 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-20090286807-A1 CYCLIC AMINE COMPOUND HRH3, HRH4, H1-0 OPRM1 138/4885OPRL1 60/4885ALDH1A1 1293/4885

“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.