SCHEMBL7024944

SCHEMBL7024944

COC(=O)Nc1cccc(C(CCNC[C@H](O)COc2ccccc2)(Cc2ccccc2)c2cccc(NC(=O)OC)c2)c1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ADRB1 P08588 13/20 0.50
ADRB3 P13945 13/20 0.50
ADRB2 P07550 5/20 0.49
ATM Q13315 1/20 0.45
CASR P41180 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44

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
SCHEMBL7028696 0.88 ADRB1 (0.50) ADRB1ADRB3ADRB2ATMMEN1
SCHEMBL7027570 0.79 ADRB1 (0.56) ADRB1ADRB3ADRB2
SCHEMBL7027312 0.79 MEN1 (0.65) ADRB1ADRB3ADRB2ATMCASR
SCHEMBL7021520 0.78 ADRB1 (0.47) ADRB1ADRB3ADRB2ATMCASR
SCHEMBL7030630 0.76 KDM4E (0.45) ADRB1ADRB3ADRB2ATMCASR
SCHEMBL7023578 0.75 ADRB1 (0.50) ADRB1ADRB3ADRB2ATMCASR
SCHEMBL7608531 0.75 ADRB1 (0.42) ADRB1ADRB3ADRB2MEN1KMT2A
SCHEMBL7032501 0.74 ALDH1A1 (0.51) ADRB1ADRB3ALDH1A1
SCHEMBL6327240 0.73 MEN1 (0.70) ADRB1ADRB3ADRB2ATMMEN1
SCHEMBL7033981 0.73 MEN1 (0.70) ADRB1ADRB3ADRB2ATMMEN1

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-20030032834-A1 Aminoalcohol derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-02-13 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-20030032834-A1 Aminoalcohol derivatives ADRB1, ADRB2, ADRB3 ADRB1 1/4885ADRB3 3/4885ADRB2 2/4885

“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.