SCHEMBL6096320

SCHEMBL6096320

Cc1ccc2c(C3=C(O)C(=O)C=C(O)C3=O)c(C)[nH]c2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MITF O75030 1/20 0.43
MAPT P10636 1/20 0.43
ALOX15 P16050 1/20 0.38
RAB9A P51151 1/20 0.38
XIAP P98170 1/20 0.37
ALDH1A1 P00352 1/20 0.36
HTT P42858 1/20 0.36
KIF11 P52732 2/20 0.36
DAO P14920 1/20 0.35
DDO Q99489 1/20 0.35
CDK4 P11802 1/20 0.35
CCND1 P24385 1/20 0.35
CAMK2B Q13554 1/20 0.35
CAMK2G Q13555 1/20 0.35
CAMK2D Q13557 1/20 0.35
CAMK2A Q9UQM7 1/20 0.35
CCR6 P51684 1/20 0.35
HKDC1 Q2TB90 1/20 0.35
LMNA P02545 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34

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
SCHEMBL6093757 0.90 ALDH1A1 (0.42) MAPTRAB9AXIAPALDH1A1HTT
SCHEMBL6110147 0.84 CCR6 (0.51) MITFMAPTRAB9AALDH1A1HTT
SCHEMBL6094945 0.80 MAP3K14 (0.44) MAPTLMNA
SCHEMBL6096397 0.78 ALDH1A1 (0.46) MAPTALDH1A1
SCHEMBL6094665 0.76 NR4A2 (0.41) RAB9AXIAPALDH1A1CDK4CCND1
SCHEMBL6094738 0.74 MITF (0.40) MITFMAPTALOX15KIF11CDK4
SCHEMBL6095842 0.74 RPA1 (0.43) MAPTRAB9AXIAPKIF11DAO
SCHEMBL6099085 0.71 KDM4E (0.44) MAPTRAB9AXIAPALDH1A1HTT
SCHEMBL12757262 0.70 CSNK2A2 (0.49) MAPTALDH1A1
SCHEMBL6256115 0.68 CCR6 (0.51) MITFMAPTRAB9AALDH1A1HTT

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-7057052-B2 Heterocyclic quinones as pharmaceutical agents DUKE UNIVERSITY (US) 2006-06-06 US disclosed
WO-2004050014-A2 SETEROCYCLIC QUINONES AS PHARMACEUTICAL AGENTS DUKE UNIVERSITY (US) 2004-06-17 WO disclosed
US-20040063774-A1 Heterocyclic quinones as pharmaceutical agents DUKE UNIVERSITY 2004-04-01 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-20040063774-A1 Heterocyclic quinones as pharmaceutical agents NQO1, RECQL, SDHA MITF 925/4885MAPT 116/4885ALOX15 1293/4885

“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.