SCHEMBL7112237

SCHEMBL7112237

O=C(O)C1Cc2ccc(OCc3ccccc3)cc2O1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 4/20 0.54
MAOB P27338 6/20 0.52
NPC1 O15118 1/20 0.52
ALDH1A1 P00352 1/20 0.52
HPGD P15428 1/20 0.52
NFKB1 P19838 1/20 0.52
GRM5 P41594 1/20 0.52
RAB9A P51151 1/20 0.52
NFKB2 Q00653 1/20 0.52
RELA Q04206 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
MAOA P21397 4/20 0.51
CA2 P00918 2/20 0.51
CA5A P35218 2/20 0.51
HTR6 P50406 1/20 0.49
FFAR1 O14842 1/20 0.48

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
SCHEMBL29052801 0.88 HTR6 (0.58) MAOBNPC1ALDH1A1HPGDNFKB1
SCHEMBL21198811 0.81 MAOB (0.59) MAOBNPC1ALDH1A1HPGDNFKB1
SCHEMBL30526452 0.81 MAOB (0.59) MAOBNPC1ALDH1A1HPGDNFKB1
SCHEMBL9490237 0.81 HTR6 (0.53) HIF1AMAOBNPC1ALDH1A1HPGD
SCHEMBL9220063 0.80 HIF1A (0.50) HIF1AMAOBNPC1ALDH1A1HPGD
SCHEMBL26103189 0.79 MAOB (0.51) HIF1AMAOBNPC1ALDH1A1HPGD
SCHEMBL7286847 0.78 GLS (0.46) MAOBALDH1A1SMN1; SMN2CA2CA5A
SCHEMBL7286852 0.78 GLS (0.46) MAOBALDH1A1SMN1; SMN2CA2CA5A
SCHEMBL7114984 0.78 MAOB (0.51) HIF1AMAOBNPC1ALDH1A1HPGD
SCHEMBL7114979 0.78 HTR6 (0.53) HIF1AMAOBNPC1ALDH1A1HPGD

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-6638972-B2 Disorders of 5HT-6 receptors WYETH 2003-10-28 US disclosed
US-20030153599-A1 Chroman and benzofuran derivatives as 5-hydroxytryptamine-6 ligands WYETH 2003-08-14 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-20030153599-A1 Chroman and benzofuran derivatives as 5-hydroxytryptamine-6 ligands HTR6, HTR1F, HTR1A HIF1A 1274/4885MAOB 92/4885NPC1 2582/4885

“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.