SCHEMBL6777964

SCHEMBL6777964

Cc1ccc(O)c(C(=O)C=Cc2ccc(OCc3ccccc3)c([N+](=O)[O-])c2)c1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CYSLTR2 Q9NS75 1/20 0.50
▸ CYSLTR1 Q9Y271 1/20 0.50
▸ APP P05067 1/20 0.50
▸ CTSV O60911 2/20 0.49
▸ CTSL P07711 2/20 0.49
▸ BACE1 P56817 1/20 0.48
▸ ALDH1A1 P00352 2/20 0.47
▸ POLB P06746 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ CTDSP1 Q9GZU7 1/20 0.47
▸ LMNA P02545 2/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ KDM4E B2RXH2 1/20 0.46

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
SCHEMBL6777958 1.00 CYSLTR2 (0.50) CYSLTR2CYSLTR1APPCTSVCTSL
SCHEMBL6772371 0.90 CTSV (0.50) APPCTSVCTSLBACE1ALDH1A1
SCHEMBL6772382 0.90 CTSV (0.50) APPCTSVCTSLBACE1ALDH1A1
SCHEMBL16076970 0.89 CTSV (0.56) CYSLTR2CYSLTR1APPCTSVCTSL
SCHEMBL6771272 0.84 CTSV (0.49) APPCTSVCTSLBACE1ALDH1A1
SCHEMBL6771284 0.84 CTSV (0.49) APPCTSVCTSLBACE1ALDH1A1
SCHEMBL6770154 0.83 BACE1 (0.48) APPBACE1ALDH1A1LMNAKDM4E
SCHEMBL6770151 0.83 BACE1 (0.48) APPBACE1ALDH1A1LMNAKDM4E
SCHEMBL8786629 0.81 KDM4E (0.63) APPCTSVCTSLBACE1ALDH1A1
SCHEMBL8786625 0.81 KDM4E (0.63) APPCTSVCTSLBACE1ALDH1A1

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 CYSLTR2 2752/4885CYSLTR1 1974/4885APP 4466/4885

“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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