SCHEMBL4392557

SCHEMBL4392557

CB(C)CC=Cc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 3/20 0.48
IDO1 P14902 2/20 0.47
PAM P19021 1/20 0.47
MAOB P27338 1/20 0.44
SIGMAR1 Q99720 2/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
CA1 P00915 1/20 0.41
CHAT P28329 1/20 0.40
KDM4E B2RXH2 1/20 0.40
RELA Q04206 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
SCHEMBL692304 0.77 CA1 (0.52) HTR2AIDO1PAMMAOBCA1
SCHEMBL692303 0.77 CA1 (0.52) HTR2AIDO1PAMMAOBCA1
SCHEMBL4863423 0.75 IDO1 (0.58) HTR2AIDO1PAMMAOBRELA
SCHEMBL9777486 0.75 IDO1 (0.58) HTR2AIDO1PAMMAOBRELA
SCHEMBL4528665 0.73 HTR2A (0.54) HTR2AIDO1PAMMAOBSIGMAR1
SCHEMBL178030 0.73 HTR2A (0.54) HTR2AIDO1PAMMAOBSIGMAR1
SCHEMBL455862 0.73 HTR2A (0.54) HTR2AIDO1PAMMAOBSIGMAR1
SCHEMBL14961 0.73 HTR2A (0.54) HTR2AIDO1PAMMAOBSIGMAR1
SCHEMBL1961951 0.73 IDO1 (0.52) HTR2AIDO1PAMMAOBSIGMAR1
Benzene SCHEMBL1226473 0.73 HTR2A (0.54) HTR2AIDO1PAMMAOBSIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8193394-B2 Process for production of lasofoxifene or analogue thereof TOKYO UNIVERSITY OF SCIENCE EDUCATIONAL FOUNDATION ADMINISTRATIVE ORGANIZATION (JP) 2012-06-05 US disclosed
US-20090012314-A1 Process for Production of Lasofoxifene or Analogue Thereof TOKYO UNIVERSITY OF SCIENCE EDUCATIONAL FOUNDATION ADMINISTRATIVE ORGANIZATION (JP) 2009-01-08 US disclosed
EP-1982981-A1 PROCESS FOR PRODUCTION OF LASOFOXIFENE OR ANALOGUE THEREOF Tokyo University of Science, Educational Foundation (JP) 2008-10-22 EP disclosed
EP-1960411-A1 HALOGEN SUBSTITUTED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION ExxonMobil Chemical Patents Inc. (US) 2008-08-27 EP disclosed
WO-2007070040-A1 HALOGEN SUBSTITUTED METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION EXXONMOBIL CHEMICAL PATENTS, INC. (US) 2007-06-21 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-20090012314-A1 Process for Production of Lasofoxifene or Analogue Thereof CYP19A1, CYP2F1, HSD17B11 HTR2A 3236/4885IDO1 3487/4885PAM 850/4885

“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.