SCHEMBL6682663

SCHEMBL6682663

COc1cccc(CNC(=O)C2CSc3c(c(=O)n(Cc4ccccc4)c(=O)n3C)C2)c1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PKM P14618 3/20 0.47
KMT2A Q03164 1/20 0.47
LMNA P02545 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ALDH1A1 P00352 3/20 0.45
MAPT P10636 2/20 0.44
TP53 P04637 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
HSD17B10 Q99714 1/20 0.44
POLB P06746 2/20 0.44
TSHR P16473 1/20 0.44
ACKR3 P25106 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
SCHEMBL6684343 0.86 MAPT (0.41) KMT2ASMN1; SMN2ALDH1A1MAPTTP53
SCHEMBL6678378 0.84 PKM (0.50) PKMKMT2ALMNAALDH1A1MAPT
SCHEMBL7119212 0.83 PKM (0.47) PKMKMT2ALMNASMN1; SMN2ALDH1A1
SCHEMBL6677958 0.80 SMN1; SMN2 (0.44) PKMKMT2ALMNASMN1; SMN2ALDH1A1
SCHEMBL6664200 0.76 MAPT (0.47) ALDH1A1MAPTTP53RXFP1
SCHEMBL6684431 0.74 KMT2A (0.49) PKMKMT2ALMNASMN1; SMN2ALDH1A1
SCHEMBL6474162 0.72 MAPT (0.56) ALDH1A1MAPTTP53RXFP1
SCHEMBL7115636 0.72 KMT2A (0.49) PKMKMT2ALMNASMN1; SMN2ALDH1A1
SCHEMBL6678882 0.71 ALDH1A1 (0.43) KMT2ASMN1; SMN2ALDH1A1MAPTTP53
SCHEMBL7116631 0.70 KMT2A (0.47) PKMKMT2ALMNASMN1; SMN2ALDH1A1

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 4 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 claimed
WO-2004014921-A1 5,6-FUSED URACIL DERIVATIVES AS MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2004-02-19 WO claimed
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 PKM 2081/4885KMT2A 3799/4885LMNA 3842/4885

“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.