SCHEMBL4707010

SCHEMBL4707010

OCC1=Cc2ccc(OCc3ccccc3)cc2OCC1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAOB P27338 15/20 0.58
MAOA P21397 5/20 0.58
GRM5 P41594 4/20 0.56
NPC1 O15118 1/20 0.56
ALDH1A1 P00352 1/20 0.56
HPGD P15428 1/20 0.56
NFKB1 P19838 1/20 0.56
RAB9A P51151 1/20 0.56
NFKB2 Q00653 1/20 0.56
RELA Q04206 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
ALOX5 P09917 2/20 0.49
CA2 P00918 2/20 0.44
CA5A P35218 2/20 0.44

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
SCHEMBL4707088 0.82 MAOB (0.58) MAOBMAOAGRM5NPC1ALDH1A1
SCHEMBL3452161 0.79 MAOB (0.52) MAOBMAOAGRM5NPC1ALDH1A1
SCHEMBL12470264 0.76 MAOB (0.70) MAOBMAOAGRM5NPC1ALDH1A1
SCHEMBL19809528 0.74 MAOB (0.56) MAOBMAOAGRM5NPC1ALDH1A1
SCHEMBL21213879 0.74 MAOB (1.00) MAOBMAOAGRM5NPC1ALDH1A1
SCHEMBL7033212 0.74 ITGB2 (0.40) NPC1NFKB1RAB9ANFKB2RELA
SCHEMBL949460 0.72 MAOB (0.51) MAOBMAOAGRM5NPC1ALDH1A1
SCHEMBL13213562 0.72 MAOB (0.54) MAOBMAOAGRM5NPC1ALDH1A1
SCHEMBL2326572 0.72 MAOB (1.00) MAOBMAOAGRM5NPC1ALDH1A1
SCHEMBL29889798 0.72 MAOB (1.00) MAOBMAOAGRM5NPC1ALDH1A1

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
EP-2001844-A2 BICYCLIC CARBOXYLIC ACID DERIVATIVES USEFUL FOR TREATING METABOLIC DISORDERS Amgen, Inc (US) 2008-12-17 EP disclosed
US-20070244155-A1 Bicyclic carboxylic acid derivatives useful for treating metabolic disorders AMGEN INC. (US) 2007-10-18 US disclosed
US-20070244155-A1 Bicyclic carboxylic acid derivatives useful for treating metabolic disorders AMGEN INC. (US) 2007-10-18 US disclosed
WO-2007106469-A2 BICYCLIC CARBOXYLIC ACID DERIVATIVES USEFUL FOR TREATING METABOLIC DISORDERS AMGEN INC. (US) 2007-09-20 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-20070244155-A1 Bicyclic carboxylic acid derivatives useful for treating metabolic disorders GOT2, PC, GOT1 MAOB 603/4885MAOA 737/4885GRM5 1163/4885

“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.