SCHEMBL6540663

SCHEMBL6540663

CCOC(=O)c1cccc(S(=O)(=O)c2ccc(CCN(C[C@H](O)c3cccc(Cl)c3)C(=O)OC(C)(C)C)cc2)c1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.36
CYP4A11 Q02928 1/20 0.36
BACE1 P56817 5/20 0.36
LMNA P02545 1/20 0.36
CA2 P00918 1/20 0.35
TP53 P04637 1/20 0.35
ADRB3 P13945 3/20 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
SCHEMBL6540667 1.00 CYP4F2 (0.36) CYP4F2CYP4A11BACE1LMNACA2
SCHEMBL6541360 0.94 TP53 (0.40) BACE1TP53ADRB3
SCHEMBL6541363 0.94 TP53 (0.40) BACE1TP53ADRB3
SCHEMBL6806565 0.92 ADRB3 (0.45) BACE1ADRB3
SCHEMBL6680864 0.92 ADRB3 (0.45) BACE1ADRB3
SCHEMBL6682203 0.91 ADRB3 (0.44) BACE1TP53ADRB3
SCHEMBL6682206 0.91 ADRB3 (0.44) BACE1TP53ADRB3
SCHEMBL6540274 0.91 ADRB3 (0.42) BACE1ADRB3
SCHEMBL6540282 0.91 ADRB3 (0.42) BACE1ADRB3
SCHEMBL6540558 0.90 CCR5 (0.38) BACE1ADRB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040138462-A1 Aminoalcohol derivatives ASTELLAS PHARMA INC. (JP) 2004-07-15 US disclosed
EP-1389185-A2 AMINOALCOHOL DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-02-18 EP disclosed
WO-2002094770-A2 AMINOALCOHOL DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-11-28 WO 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-20040138462-A1 Aminoalcohol derivatives BPHL, FANCD2, HRH2 CYP4F2 3647/4885CYP4A11 3040/4885BACE1 3900/4885

“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.