SCHEMBL799753

SCHEMBL799753

O=C1c2ccc(O)cc2OCC1Cc1ccc(O)cc1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.58
CYP26A1 O43174 6/20 0.58
CYP3A4 P08684 4/20 0.55
MAPT P10636 3/20 0.55
HPGD P15428 2/20 0.55
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
ALOX12 P18054 2/20 0.55
USP2 O75604 1/20 0.55
ALDH1A1 P00352 1/20 0.55
TP53 P04637 1/20 0.55
ALOX15 P16050 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.52
CYP19A1 P11511 3/20 0.49
CYP24A1 Q07973 1/20 0.47
HDAC1 Q13547 1/20 0.46
MAOA P21397 1/20 0.45

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
SCHEMBL13982628 0.89 CYP3A4 (0.60) MAOBCYP26A1CYP3A4MAPTHPGD
SCHEMBL29827413 0.89 CYP3A4 (0.60) MAOBCYP26A1CYP3A4MAPTHPGD
SCHEMBL8461403 0.82 MAOB (0.52) MAOBCYP26A1CYP3A4MAPTHPGD
SCHEMBL23882822 0.82 MAOB (0.51) MAOBCYP26A1CYP3A4MAPTHPGD
SCHEMBL31500685 0.82 MAOB (0.55) MAOBCYP26A1CYP3A4MAPTHPGD
SCHEMBL31500686 0.82 MAOB (0.55) MAOBCYP26A1CYP3A4MAPTHPGD
SCHEMBL8461434 0.82 MAOB (0.70) MAOBCYP26A1CYP3A4MAPTHPGD
SCHEMBL8466024 0.81 MAOB (0.54) MAOBCYP26A1CYP3A4MAPTHPGD
SCHEMBL8462840 0.80 CYP19A1 (0.60) MAOBCYP26A1CYP3A4MAPTHPGD
SCHEMBL8465454 0.79 MAOB (0.56) MAOBCYP26A1CYP3A4MAPTHPGD

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-8431166-B2 Composition comprising the extract of Anemarrhena asphodeloides Bunge or the compounds isolated from the same for preventing and treating lipid metabolism disorder EWHA UNIVERSITY-INDUSTRY COLLABORATION FOUNDATION (KR) 2013-04-30 US disclosed
US-8431166-B2 Composition comprising the extract of Anemarrhena asphodeloides Bunge or the compounds isolated from the same for preventing and treating lipid metabolism disorder EWHA UNIVERSITY-INDUSTRY COLLABORATION FOUNDATION (KR) 2013-04-30 US disclosed
US-20120070515-A1 Composition Comprising the Extract of Anemarrhena Asphodeloides Bunge or the Compounds Isolated from the Same for Preventing and Treating Lipid Metabolism Disorder EWHA UNIVERSITY- INDUSTRY COLLABORATION FOUNDATION (KR) 2012-03-22 US disclosed
US-20120070515-A1 Composition Comprising the Extract of Anemarrhena Asphodeloides Bunge or the Compounds Isolated from the Same for Preventing and Treating Lipid Metabolism Disorder EWHA UNIVERSITY- INDUSTRY COLLABORATION FOUNDATION (KR) 2012-03-22 US disclosed
WO-2010120029-A1 COMPOSITION COMPRISING THE EXTRACT OF ANEMARRHENA ASPHODELOIDES BUNGE OR THE COMPOUNDS ISOLATED FROM THE SAME FOR PREVENTING AND TREATING LIPID METABOLISM DISORDER EWHA UNIVERSITY - INDUSTRY COLLABORATION FOUNDATION (KR) 2010-10-21 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-20120070515-A1 Composition Comprising the Extract of Anemarrhena Asphodeloides Bunge or the Compounds Isolated from the Same for Preventing and Treating Lipid Metabolism Disorder FABP4, ACACB, LIPC MAOB 3070/4885CYP26A1 927/4885CYP3A4 1261/4885

“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.