SCHEMBL7250767

SCHEMBL7250767

O=CNc1cc(OC[C@@H](O)CN[C@H](CO)Cc2ccc(O)cc2)ccc1O

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 15/20 0.49
ADRB1 P08588 14/20 0.49
ADRB2 P07550 8/20 0.49
DRD2 P14416 2/20 0.46
PGR P06401 1/20 0.46
SLC6A4 P31645 1/20 0.46
ADRA1A P35348 1/20 0.46
PTGS2 P35354 1/20 0.46
SLC6A3 Q01959 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
TSHR P16473 1/20 0.46
MAPK1 P28482 1/20 0.46
CYP2C19 P33261 1/20 0.46
DRD3 P35462 1/20 0.46
PTGS1 P23219 1/20 0.43
SLC6A2 P23975 1/20 0.43

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
SCHEMBL7250772 1.00 ADRB3 (0.49) ADRB3ADRB1ADRB2DRD2PGR
SCHEMBL7042586 0.82 ADRB3 (0.55) ADRB3ADRB1ADRB2PTGS1SLC6A2
SCHEMBL7042485 0.81 ADRB3 (0.52) ADRB3ADRB1ADRB2
SCHEMBL7042681 0.80 ADRB3 (0.45) ADRB3ADRB1ADRB2
SCHEMBL7042476 0.80 ADRB3 (0.54) ADRB3ADRB1ADRB2
SCHEMBL7610387 0.78 ADRB2 (0.46) ADRB3ADRB1ADRB2DRD2PGR
SCHEMBL7041021 0.77 ADRB3 (0.71) ADRB3ADRB1ADRB2CYP2D6PTGS1
Hydrochloric Acid SCHEMBL7039782 0.76 ADRB3 (0.70) ADRB3ADRB1ADRB2CYP2D6PTGS1
Hydrochloric Acid SCHEMBL7248953 0.76 ADRB3 (0.70) ADRB3ADRB1ADRB2CYP2D6PTGS1
Hydrochloric Acid SCHEMBL7040329 0.76 ADRB3 (0.70) ADRB3ADRB1ADRB2CYP2D6PTGS1

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 ADRB3 20/4885ADRB1 3/4885ADRB2 4/4885

“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.