SCHEMBL6409629

SCHEMBL6409629

O=C(Nc1ccc(C(=O)O)cc1O)C(=O)Nc1cc(Cl)cc(Cl)c1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM5A P29375 1/20 0.47
ACLY P53396 2/20 0.46
HSPA5 P11021 1/20 0.46
TTR P02766 2/20 0.45
STK39 Q9UEW8 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 2/20 0.42
PYGL P06737 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
MAPT P10636 2/20 0.41
POLB P06746 2/20 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
SCHEMBL6414640 0.89 ACLY (0.49) KDM5AACLYHSPA5TTRMEN1
SCHEMBL6408508 0.85 ACLY (0.49) ACLYHSPA5STK39MEN1KMT2A
SCHEMBL6407492 0.82 CXCR2 (0.47) HSPA5STK39MEN1KMT2AKDM4E
SCHEMBL6410292 0.82 HSPA5 (0.62) ACLYHSPA5TTRSTK39MEN1
SCHEMBL6407663 0.80 NPC1 (0.50) HSPA5STK39MEN1KMT2AALDH1A1
SCHEMBL6408135 0.78 KCNMA1 (0.55) HSPA5MEN1KMT2APOLBTSHR
SCHEMBL6407734 0.78 HSPA5 (0.51) ACLYHSPA5STK39MEN1KMT2A
SCHEMBL6413311 0.77 CXCR1 (0.51) MEN1KMT2AALDH1A1MAPTPOLB
SCHEMBL16689759 0.77 MEN1 (0.60) KDM5AACLYMEN1KMT2AKDM4E
SCHEMBL27041427 0.77 MEN1 (0.60) KDM5AACLYMEN1KMT2AKDM4E

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 KDM5A 3024/4885ACLY 2109/4885HSPA5 4261/4885

“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.