SCHEMBL6414640

SCHEMBL6414640

O=C(Nc1cc(C(=O)O)ccc1O)C(=O)Nc1cc(Cl)cc(Cl)c1O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACLY P53396 2/20 0.49
KCNMA1 Q12791 5/20 0.47
KDM5A P29375 1/20 0.47
HSPA5 P11021 1/20 0.46
POLB P06746 2/20 0.46
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
ALDH1A1 P00352 2/20 0.44
MAPT P10636 2/20 0.44
KDM4E B2RXH2 2/20 0.42
GPR35 Q9HC97 1/20 0.42
TTR P02766 2/20 0.42
AKR1C4 P17516 1/20 0.41
AKR1C3 P42330 1/20 0.41
AKR1C2 P52895 1/20 0.41
AKR1C1 Q04828 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
GAA P10253 1/20 0.41

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
SCHEMBL6409629 0.89 KDM5A (0.47) ACLYKDM5AHSPA5POLBMEN1
SCHEMBL6408135 0.87 KCNMA1 (0.55) KCNMA1HSPA5POLBMEN1KMT2A
SCHEMBL6407658 0.85 CA1 (0.48) ACLYKCNMA1HSPA5POLBMAPT
SCHEMBL6410312 0.82 KCNMA1 (0.52) ACLYKCNMA1HSPA5POLBKDM4E
SCHEMBL6415342 0.82 HSPA5 (0.47) KCNMA1HSPA5POLBMEN1KMT2A
SCHEMBL6410292 0.82 HSPA5 (0.62) ACLYHSPA5POLBMEN1KMT2A
SCHEMBL6409044 0.81 KMT2A (0.50) ACLYKCNMA1HSPA5POLBMEN1
SCHEMBL6408459 0.81 ACLY (0.59) ACLYKCNMA1KDM4E
SCHEMBL6407663 0.80 NPC1 (0.50) KCNMA1HSPA5POLBMEN1KMT2A
SCHEMBL6410608 0.79 NPC1 (0.53) KCNMA1MEN1KMT2AALDH1A1MAPT

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-20050124667-A1 Oxamide inhibitors of plasminogen activator inhibitor-1 CEREP SA (FR) 2005-06-09 US claimed
US-20050124667-A1 Oxamide inhibitors of plasminogen activator inhibitor-1 CEREP SA (FR) 2005-06-09 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-20050124667-A1 Oxamide inhibitors of plasminogen activator inhibitor-1 SERPINE1, SERPINC1, SERPINB1 ACLY 2109/4885KCNMA1 2149/4885KDM5A 3024/4885

“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.