SCHEMBL7245302

SCHEMBL7245302

COc1ccc(C[C@@H](CO)N(Cc2ccccc2)C[C@H](O)c2ccc(OCc3ccccc3)c(N)c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 2/20 0.39
OPRK1 P41145 2/20 0.39
AOC3 Q16853 2/20 0.37
C5AR1 P21730 1/20 0.37
ALDH1A1 P00352 2/20 0.37
ABCB1 P08183 1/20 0.37
TSHR P16473 1/20 0.36
NPC1 O15118 2/20 0.36
POLB P06746 1/20 0.36
EPOR P19235 1/20 0.36
LTA4H P09960 1/20 0.36
RAB9A P51151 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
MAOB P27338 1/20 0.35

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
SCHEMBL7245309 1.00 OPRD1 (0.39) OPRD1OPRK1AOC3C5AR1ALDH1A1
SCHEMBL7037077 0.93 OPRD1 (0.37) OPRD1OPRK1ALDH1A1
SCHEMBL28019387 0.90 ALDH1A1 (0.41) AOC3ALDH1A1ABCB1TSHRNPC1
SCHEMBL719264 0.90 ALDH1A1 (0.41) AOC3ALDH1A1ABCB1TSHRNPC1
SCHEMBL719263 0.90 ALDH1A1 (0.41) AOC3ALDH1A1ABCB1TSHRNPC1
SCHEMBL7686556 0.88 OPRD1 (0.37) OPRD1OPRK1C5AR1ALDH1A1POLB
SCHEMBL6493560 0.87 ADAMTS4 (0.37) OPRD1OPRK1EPORLTA4H
SCHEMBL6493557 0.87 ADAMTS4 (0.37) OPRD1OPRK1EPORLTA4H
SCHEMBL7688304 0.87 PDGFRA (0.37)
SCHEMBL7688302 0.87 PDGFRA (0.37)

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 OPRD1 14/4885OPRK1 36/4885AOC3 341/4885

“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.