SCHEMBL6684431

SCHEMBL6684431

COc1cccc(CNC(=O)C2Sc3c(n(C)c(=O)n(Cc4ccccc4)c3=O)NC2=O)c1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.49
MEN1 O00255 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2C9 P11712 1/20 0.49
NR3C2 P08235 1/20 0.45
ALDH1A1 P00352 2/20 0.45
LMNA P02545 2/20 0.45
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
RXFP1 Q9HBX9 3/20 0.43
CASP3 P42574 1/20 0.43
MAPT P10636 2/20 0.43
TP53 P04637 2/20 0.43
POLB P06746 1/20 0.42
PKM P14618 1/20 0.42
KDM4E B2RXH2 1/20 0.42

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
SCHEMBL6678368 0.85 MEN1 (0.41) KMT2AMEN1CYP3A4CYP2C9ALDH1A1
SCHEMBL6679197 0.84 ALDH1A1 (0.49) KMT2AMEN1CYP3A4CYP2C9ALDH1A1
SCHEMBL7115636 0.82 KMT2A (0.49) KMT2AMEN1CYP3A4CYP2C9NR3C2
SCHEMBL7116631 0.81 KMT2A (0.47) KMT2AMEN1CYP3A4CYP2C9NR3C2
SCHEMBL6685134 0.80 MAPT (0.49) NR3C2ALDH1A1HTTSMN1; SMN2RXFP1
SCHEMBL6683575 0.79 GAA (0.46) KMT2AMEN1CYP3A4CYP2C9ALDH1A1
SCHEMBL6788504 0.76 ALDH1A1 (0.39) KMT2AMEN1CYP3A4CYP2C9ALDH1A1
SCHEMBL6789742 0.75 LMNA (0.40) KMT2AMEN1CYP3A4CYP2C9ALDH1A1
SCHEMBL6682663 0.74 PKM (0.47) KMT2ACYP3A4CYP2C9ALDH1A1LMNA
SCHEMBL6678378 0.73 PKM (0.50) KMT2AMEN1CYP3A4CYP2C9ALDH1A1

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-20040224951-A1 5,6-Fused uracil derivatives as matrix metalloproteinase inhibitors ROARK WILLIAM HOWARD (US) 2004-11-11 US disclosed
WO-2004014921-A1 5,6-FUSED URACIL DERIVATIVES AS MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2004-02-19 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-20040224951-A1 5,6-Fused uracil derivatives as matrix metalloproteinase inhibitors MMP9, MMP13, MMP25 KMT2A 3799/4885MEN1 3549/4885CYP3A4 1686/4885

“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.