SCHEMBL7032043

SCHEMBL7032043

CC(=O)c1ccc(-n2c(=O)[nH]c3sc(C(=O)OCc4ccccc4)c(C)c3c2=O)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
ALDH1A1 P00352 2/20 0.45
POLB P06746 2/20 0.45
CYP2C9 P11712 1/20 0.45
HPGD P15428 1/20 0.45
SMN1; SMN2 Q16637 4/20 0.42
NPC1 O15118 2/20 0.42
GAA P10253 1/20 0.42
RAB9A P51151 4/20 0.41
MAPK1 P28482 1/20 0.41
MAPT P10636 3/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
ACACB O00763 1/20 0.39
ACACA Q13085 1/20 0.39
ADORA2B P29275 1/20 0.38
TSHR P16473 1/20 0.38
PDE4A P27815 1/20 0.38
PDE4B Q07343 1/20 0.38

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
SCHEMBL7030156 0.79 ACACB (0.58) MEN1KMT2ASMN1; SMN2GAAMAPT
SCHEMBL13902205 0.79 KMT2A (0.39) MEN1KMT2AALDH1A1POLBCYP2C9
SCHEMBL7030153 0.77 KMT2A (0.41) MEN1KMT2AALDH1A1POLBCYP2C9
SCHEMBL6256079 0.76 MEN1 (0.51) MEN1KMT2AALDH1A1SMN1; SMN2RAB9A
SCHEMBL6254691 0.76 MEN1 (0.51) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL18959775 0.76 KMT2A (0.46) MEN1KMT2AALDH1A1POLBCYP2C9
SCHEMBL6260255 0.75 MEN1 (0.49) MEN1KMT2AALDH1A1SMN1; SMN2NPC1
SCHEMBL14945611 0.73 ADORA2B (0.54) MEN1KMT2AALDH1A1POLBCYP2C9
SCHEMBL18135173 0.72 KMT2A (0.48) MEN1KMT2AALDH1A1POLBCYP2C9
SCHEMBL7145713 0.70 MMP13 (0.43) MEN1KMT2AALDH1A1POLBCYP2C9

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030004172-A1 Fused pyrimidinone matrix metalloproteinase inhibitors HARTER WILLIAM GLEN (US) 2003-01-02 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-20030004172-A1 Fused pyrimidinone matrix metalloproteinase inhibitors MMP13, MMP3, MMP25 MEN1 3056/4885KMT2A 1976/4885ALDH1A1 812/4885

“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.