SCHEMBL2400569

SCHEMBL2400569

CN(CCCNC1=CC(=O)c2sc(C(=O)N3CCN(C(=O)c4ccco4)CC3)nc2C1=O)CCCNC1=CC(=O)c2sc(C(=O)N3CCN(C(=O)c4ccco4)CC3)nc2C1=O

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.41
CDC25A P30304 1/20 0.41
CDC25B P30305 1/20 0.41
CDC25C P30307 1/20 0.41
NPSR1 Q6W5P4 1/20 0.40
TP53 P04637 4/20 0.39
TSHR P16473 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
MAPT P10636 5/20 0.38
ALDH1A1 P00352 4/20 0.38
HSD17B10 Q99714 2/20 0.38
ALOX15 P16050 1/20 0.38
HTT P42858 1/20 0.38
GLA P06280 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
GAA P10253 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
SCHEMBL3556819 0.92 CDC25A (0.51) POLBCDC25ACDC25BCDC25CNPSR1
SCHEMBL2399162 0.85 CDC25A (0.45) CDC25ACDC25BCDC25CTP53TSHR
SCHEMBL2399863 0.84 CDC25A (0.42) POLBCDC25ACDC25BCDC25CTSHR
SCHEMBL2404197 0.84 CDC25A (0.44) CDC25ACDC25BCDC25CNPSR1TP53
SCHEMBL2401270 0.82 HPGD (0.48) CDC25ACDC25BCDC25CTSHRMAPT
SCHEMBL2399858 0.80 ALDH1A1 (0.40) POLBCDC25ACDC25BCDC25CNPSR1
SCHEMBL2403283 0.79 CDC25A (0.52) POLBCDC25ACDC25BCDC25CTSHR
SCHEMBL2398551 0.79 CDC25A (0.38) POLBCDC25ACDC25BCDC25CNPSR1
SCHEMBL2398451 0.79 CDK4 (0.48) CDC25ACDC25BCDC25CTSHRALDH1A1
SCHEMBL3548778 0.76 CDC25A (0.60) CDC25ACDC25BCDC25CTSHRMAPT

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 POLB 2148/4885CDC25A 2/4885CDC25B 3/4885

“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.