SCHEMBL6091480

SCHEMBL6091480

O=C(C=Cc1ccc(OCc2ccccc2)cc1)C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 4/20 0.61
BACE1 P56817 4/20 0.61
EPHX2 P34913 5/20 0.58
ABCG2 Q9UNQ0 1/20 0.55
FAAH O00519 1/20 0.55
CNR2 P34972 1/20 0.55
MAOB P27338 2/20 0.53
SLC5A1 P13866 1/20 0.53
SLC5A2 P31639 1/20 0.53
KDM4E B2RXH2 1/20 0.52
MEN1 O00255 1/20 0.52
TP53 P04637 1/20 0.52
MAPT P10636 1/20 0.52
KMT2A Q03164 1/20 0.52
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
APP P05067 1/20 0.49

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
SCHEMBL5503711 0.87 ALDH1A1 (0.65) GSK3BBACE1EPHX2FAAHCNR2
SCHEMBL12040547 0.82 GABBR2 (0.53) CNR2MAOBKDM4EMEN1MAPT
SCHEMBL6091145 0.82 GABBR2 (0.53) CNR2MAOBKDM4EMEN1MAPT
SCHEMBL7054733 0.81 GSK3B (0.76) GSK3BBACE1ABCG2MAOBSLC5A1
SCHEMBL7054731 0.81 GSK3B (0.76) GSK3BBACE1ABCG2MAOBSLC5A1
SCHEMBL6090681 0.79 RARB (0.51) MEN1MAPTKMT2ASMN1; SMN2
SCHEMBL6093637 0.78 F3 (0.55) GSK3BBACE1MEN1MAPTKMT2A
SCHEMBL527827 0.78 GSK3B (0.80) GSK3BBACE1ABCG2MAOBSLC5A1
SCHEMBL7999149 0.78 GSK3B (0.83) GSK3BBACE1ABCG2MAOBSLC5A1
SCHEMBL8740053 0.78 GSK3B (0.80) GSK3BBACE1ABCG2MAOBSLC5A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060074083-A1 Cyclic and acyclic propenones for treating CNS disorders MERZ PHARMA GMBH & CO. KGAA (DE) 2006-04-06 US claimed
US-20060074083-A1 Cyclic and acyclic propenones for treating CNS disorders MERZ PHARMA GMBH & CO. KGAA (DE) 2006-04-06 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-20060074083-A1 Cyclic and acyclic propenones for treating CNS disorders PMP22, ADCYAP1R1, CYP11B2 GSK3B 419/4885BACE1 461/4885EPHX2 1257/4885

“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.