SCHEMBL2401747

SCHEMBL2401747

CN(CCCNC1=CC(=O)c2nc(-c3cccc(Br)c3)oc2C1=O)CCCNC1=CC(=O)c2nc(-c3cccc(Br)c3)oc2C1=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC25A P30304 1/20 0.49
CDC25B P30305 1/20 0.49
CDC25C P30307 1/20 0.49
S100A4 P26447 1/20 0.39
KDM4E B2RXH2 8/20 0.38
ALDH1A1 P00352 5/20 0.38
HSD17B10 Q99714 5/20 0.38
HPGD P15428 4/20 0.38
GAA P10253 2/20 0.35
NPC1 O15118 5/20 0.34
RAB9A P51151 5/20 0.34
MAPT P10636 5/20 0.34
HDAC6 Q9UBN7 1/20 0.34
KMT2A Q03164 3/20 0.34
NPSR1 Q6W5P4 2/20 0.34
XBP1 P17861 1/20 0.34
MAPK1 P28482 1/20 0.34
UBE2N P61088 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
USP1 O94782 1/20 0.33

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
SCHEMBL1918387 0.90 CDC25A (0.61) CDC25ACDC25BCDC25CKDM4EALDH1A1
SCHEMBL2398596 0.90 CDC25A (0.50) CDC25ACDC25BCDC25CS100A4KDM4E
SCHEMBL2403256 0.88 CDC25A (0.52) CDC25ACDC25BCDC25CS100A4KDM4E
SCHEMBL2398528 0.88 CDC25A (0.50) CDC25ACDC25BCDC25CS100A4KDM4E
SCHEMBL2400556 0.85 CDC25A (0.48) CDC25ACDC25BCDC25CS100A4KDM4E
SCHEMBL1917778 0.82 CDC25A (0.51) CDC25ACDC25BCDC25CKDM4EALDH1A1
SCHEMBL2401252 0.82 CDC25A (0.57) CDC25ACDC25BCDC25CS100A4ALDH1A1
SCHEMBL2404412 0.82 CDC25A (0.60) CDC25ACDC25BCDC25CS100A4KDM4E
SCHEMBL2401246 0.81 CDC25A (0.49) CDC25ACDC25BCDC25CS100A4KDM4E
SCHEMBL4868991 0.81 S100A4 (0.43) CDC25ACDC25BCDC25CS100A4KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090275624-A1 INHIBITORS OF CDC PHOSPHATASES SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 2009-11-05 US claimed
EP-1831209-B1 CDC25 PHOSPHATASE INHIBITORS IPSEN PHARMA (FR) 2009-08-12 EP claimed
US-8017637-B2 Inhibitors of cdc phosphatases IPSEN PHARMA S.A.S. (FR) 2011-09-13 US disclosed
US-20090275624-A1 INHIBITORS OF CDC PHOSPHATASES SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 2009-11-05 US disclosed
EP-1831209-B1 CDC25 PHOSPHATASE INHIBITORS IPSEN PHARMA (FR) 2009-08-12 EP disclosed
EP-1831209-A2 CDC25 PHOSPHATASE INHIBITORS Société de Conseils de Recherches et d'Applications Scientifiques SAS (S.C.R.A.S) (FR) 2007-09-12 EP disclosed
WO-2006067311-A2 CDC25 PHOSPHATASE INHIBITORS SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) SAS (FR) 2006-06-29 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-20090275624-A1 INHIBITORS OF CDC PHOSPHATASES CDC25C, CDC25A, CDC25B CDC25A 2/4885CDC25B 3/4885CDC25C 1/4885

“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.