SCHEMBL6730293

SCHEMBL6730293

Cn1c(=O)[nH]c(=O)c2cc(C(=O)OCCN3CCOCC3)sc21

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.49
KMT2A Q03164 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.44
ATM Q13315 1/20 0.44
SMN1; SMN2 Q16637 4/20 0.43
ALDH1A1 P00352 6/20 0.42
KDM4E B2RXH2 4/20 0.40
HPGD P15428 3/20 0.40
CYP1A2 P05177 2/20 0.40
GAA P10253 2/20 0.40
TP53 P04637 1/20 0.40
HSD17B10 Q99714 1/20 0.40
CYP3A4 P08684 1/20 0.39
MAPT P10636 1/20 0.39
CYP2C19 P33261 1/20 0.39
PKM P14618 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
SCHEMBL6255590 0.74 KDM4E (0.41) LMNAALDH1A1KDM4EHPGDGAA
SCHEMBL6261894 0.72 KDM4E (0.41) LMNAKMT2AALDH1A1KDM4EHPGD
SCHEMBL6259014 0.68 HSD17B10 (0.38) LMNAALDH1A1KDM4EHPGDHSD17B10
Hydrochloric Acid SCHEMBL11864237 0.67 PARP1 (0.58) LMNAKMT2AL3MBTL1ATMSMN1; SMN2
SCHEMBL29233551 0.67 CYP1A2 (0.63) LMNAKMT2AL3MBTL1ATMSMN1; SMN2
SCHEMBL24177757 0.67 LMNA (0.97) LMNAKMT2AL3MBTL1ATMSMN1; SMN2
SCHEMBL6736666 0.67 SRC (0.46) KMT2ASMN1; SMN2ALDH1A1KDM4EHSD17B10
SCHEMBL6253952 0.66 MAPT (0.48) LMNAL3MBTL1ALDH1A1KDM4EHPGD
SCHEMBL13771215 0.66 LMNA (0.57) LMNAKMT2AL3MBTL1ATMSMN1; SMN2
SCHEMBL6724733 0.65 SRC (0.51) LMNAKMT2ASMN1; SMN2ALDH1A1KDM4E

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 6 patents. 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 claimed
US-20040019053-A1 Combination of an allosteric carboxylic inhibitor of matrix metalloproteinase-13 with celecoxib or valdecoxib ROARK WILLIAM HOWARD (US) 2004-01-29 US disclosed
US-20040019054-A1 Combination of an allosteric carboxylic inhibitor of matrix metalloproteinase-13 with a selective inhibitor of cyclooxygenase-2 that is not celecoxib or valdecoxib ROARK WILLIAM HOWARD (US) 2004-01-29 US disclosed
EP-1370562-A1 THIENO[2,3-D]PYRIMIDINDIONE DERIVATIVES AS MATRIX METALLOPROTEINASE INHIBITORS Warner-Lambert Company LLC (US) 2003-12-17 EP disclosed
US-20030004172-A1 Fused pyrimidinone matrix metalloproteinase inhibitors HARTER WILLIAM GLEN (US) 2003-01-02 US disclosed
WO-2002064598-A1 THIENO'2,3-D PYRIMIDINDIONE DERIVATIVES AS MATRIX METALLOPROTEINASE INHIBITORS WARNER-LAMBERT COMPANY LLC (US) 2002-08-22 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 (3 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 LMNA 1210/4885KMT2A 1976/4885L3MBTL1 3703/4885
US-20040019053-A1 Combination of an allosteric carboxylic inhibitor of matrix metalloproteinase-13 with celecoxib or valdecoxib MMP13, MMP11, MMP10 LMNA 4372/4885KMT2A 1264/4885L3MBTL1 4723/4885
US-20040019054-A1 Combination of an allosteric carboxylic inhibitor of matrix metalloproteinase-13 with a selective inhibitor of cyclooxygenase-2 that is not celecoxib or valdecoxib MMP13, MMP11, MMP10 LMNA 4296/4885KMT2A 1331/4885L3MBTL1 4656/4885

“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.