SCHEMBL7252017

SCHEMBL7252017

OCc1cc(OCC(O)CN(Cc2ccccc2)[C@@H](O)CCc2ccc(O)cc2)ccc1OCc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BCHE P06276 3/20 0.42
ABCB1 P08183 4/20 0.41
ALDH1A1 P00352 3/20 0.39
ELANE P08246 3/20 0.39
F2 P00734 1/20 0.39
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
MAPK1 P28482 1/20 0.38
TSHR P16473 1/20 0.38
ADRB3 P13945 2/20 0.37
ADRB2 P07550 1/20 0.37
ADRB1 P08588 1/20 0.37
SLC2A1 P11166 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
MMP12 P39900 1/20 0.37

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
SCHEMBL7042715 0.85 OPRD1 (0.40) BCHEABCB1ALDH1A1ELANEF2
SCHEMBL7176605 0.84 ABCB1 (0.44) BCHEABCB1ALDH1A1GAAMAPT
SCHEMBL7042722 0.84 ALDH1A1 (0.41) ABCB1ALDH1A1ELANEF2GAA
SCHEMBL7251318 0.83 BCHE (0.48) BCHEABCB1ALDH1A1GAAMAPT
SCHEMBL7606264 0.80 ALDH1A1 (0.46) BCHEABCB1ALDH1A1ELANEF2
SCHEMBL7246404 0.80 BCHE (0.44) BCHEABCB1ALDH1A1MAPTMEN1
SCHEMBL7245922 0.79 POLB (0.43) BCHEABCB1ALDH1A1GAAMAPT
SCHEMBL7245999 0.76 CTSV (0.41) BCHEABCB1ALDH1A1MAPTMEN1
SCHEMBL7037109 0.74 BCHE (0.43) BCHEABCB1ALDH1A1MAPTMEN1
SCHEMBL6539481 0.74 RAB9A (0.45) MAPTADRB3ADRB2ADRB1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030073846-A1 Aminoalcohol derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-04-17 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-20030073846-A1 Aminoalcohol derivatives XDH, ADH1A, ADRB1 BCHE 3174/4885ABCB1 2117/4885ALDH1A1 103/4885

“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.