SCHEMBL6094738

SCHEMBL6094738

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

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MITF O75030 1/20 0.40
MAPT P10636 1/20 0.40
KIF11 P52732 1/20 0.36
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
SMN1; SMN2 Q16637 2/20 0.33
TP53 P04637 1/20 0.33
PTGES O14684 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ALOX15 P16050 1/20 0.33

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
SCHEMBL6096284 0.90 HSD17B10 (0.42) MAPTLMNASMN1; SMN2TP53HSD17B10
SCHEMBL29690580 0.84 CCR6 (0.51) MITFMAPTCAMK2DCCR6HKDC1
SCHEMBL6094022 0.84 CCR6 (0.51) MITFMAPTCAMK2DCCR6HKDC1
SCHEMBL6094704 0.82 LMNA (0.46) MAPTLMNA
SCHEMBL6098106 0.78 ALDH1A1 (0.45) MAPTHKDC1LMNARXFP1SMN1; SMN2
SCHEMBL6098483 0.76 MEN1 (0.40) CDK4CCND1CAMK2D
SCHEMBL29690625 0.76 CCR6 (0.51) MITFMAPTCCR6HKDC1LMNA
SCHEMBL6096320 0.74 MITF (0.43) MITFMAPTKIF11CDK4CCND1
SCHEMBL6097317 0.74 AHR (0.43) MAPTKIF11RXFP1
SCHEMBL6094987 0.71 MEN1 (0.41) MAPTLMNASMN1; SMN2TP53HSD17B10

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 116/4885KIF11 1626/4885

“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.