SCHEMBL6770154

SCHEMBL6770154

Cc1cc(C(=O)C=Cc2ccc(OCc3ccccc3)c(C)c2)c(O)c([N+](=O)[O-])c1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 1/20 0.48
▸ APP P05067 3/20 0.48
▸ LMNA P02545 3/20 0.46
▸ KDM4E B2RXH2 2/20 0.46
▸ PDE4A P27815 1/20 0.45
▸ PDE4B Q07343 1/20 0.45
▸ PDE4C Q08493 1/20 0.45
▸ PDE4D Q08499 1/20 0.45
▸ ALDH1A1 P00352 3/20 0.44
▸ HPGD P15428 2/20 0.44
▸ THRB P10828 1/20 0.44
▸ SLC5A1 P13866 1/20 0.44
▸ SLC5A2 P31639 1/20 0.44
▸ AKR1C3 P42330 1/20 0.44
▸ MAOA P21397 1/20 0.43
▸ MAOB P27338 1/20 0.43
▸ ABCG2 Q9UNQ0 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
SCHEMBL6770151 1.00 BACE1 (0.48) BACE1APPLMNAKDM4EPDE4A
SCHEMBL6772371 0.93 CTSV (0.50) BACE1APPLMNAKDM4EPDE4A
SCHEMBL6772382 0.93 CTSV (0.50) BACE1APPLMNAKDM4EPDE4A
SCHEMBL6776289 0.91 BACE1 (0.47) BACE1APPLMNAKDM4EPDE4A
SCHEMBL6776282 0.91 BACE1 (0.47) BACE1APPLMNAKDM4EPDE4A
SCHEMBL6770296 0.88 APP (0.61) BACE1APPKDM4ESLC5A1SLC5A2
SCHEMBL6770302 0.88 APP (0.61) BACE1APPKDM4ESLC5A1SLC5A2
SCHEMBL6770519 0.86 CYSLTR2 (0.58) BACE1APPLMNAKDM4EALDH1A1
SCHEMBL6770521 0.86 CYSLTR2 (0.58) BACE1APPLMNAKDM4EALDH1A1
SCHEMBL6777964 0.83 CYSLTR2 (0.50) BACE1APPLMNAKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6683095-B2 ANTICARCINOGENIC AGENTS; ANTIPROLIFERATION AGENTS LG LIFE SCIENCES LTD. (KR) 2004-01-27 — — US disclosed
US-20030125356-A1 Cdk inhibitors having 3-hydroxychromen-4-one structure LG LIFE SCIENCES LTD. (KR) 2003-07-03 — — 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-20030125356-A1 Cdk inhibitors having 3-hydroxychromen-4-one structure CDK4, CDK3, CDK6 BACE1 3740/4885APP 4466/4885LMNA 2753/4885

“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.

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