SCHEMBL4239096

SCHEMBL4239096

CCOP(=O)(OCC)Oc1ccc(CCNC(=O)c2cc3cc(O)ccc3cc2O)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLA1 P09884 1/20 0.50
AKR1B10 O60218 2/20 0.47
AKR1B1 P15121 2/20 0.47
SYK P43405 2/20 0.46
ADORA2A P29274 1/20 0.42
ADORA2B P29275 1/20 0.42
ESRRG P62508 4/20 0.42
ESRRB O95718 3/20 0.42
DNMT3A Q9Y6K1 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA4 P22748 1/20 0.41
CA5A P35218 1/20 0.41
CA7 P43166 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
SCHEMBL1918047 0.86 POLA1 (0.55) POLA1AKR1B10AKR1B1SYKADORA2A
Butane SCHEMBL5179499 0.80 POLA1 (0.55) POLA1AKR1B10AKR1B1SYKESRRG
SCHEMBL6081018 0.79 CA1 (0.54) POLA1KDM4EALDH1A1CA12CA1
SCHEMBL1919137 0.79 POLA1 (0.59) POLA1AKR1B10AKR1B1SYKESRRG
SCHEMBL5179500 0.79 POLA1 (0.54) POLA1AKR1B10AKR1B1SYKESRRG
SCHEMBL1918021 0.76 CA1 (0.57) POLA1AKR1B10AKR1B1ALDH1A1CA12
SCHEMBL6413567 0.76 NPC1 (0.51) MAPTCA1CA2
SCHEMBL1918691 0.76 GSK3B (0.55) POLA1AKR1B10AKR1B1SYK
SCHEMBL1918086 0.75 POLA1 (0.55) POLA1AKR1B10AKR1B1SYKKDM4E
SCHEMBL27481085 0.75 MAPT (0.67) POLA1AKR1B10AKR1B1SYKADORA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060235027-A1 Inhibitors of cdc25 phosphatases SCRAS 2006-10-19 US claimed
US-20040034103-A1 Cdc25 photophatase inhibitors IPSEN PHARMA S.A.S. (FR) 2004-02-19 US claimed
CN-1474689-A CDC25 phosphatase inhibitors ��ѧ�о���Ӧ����ѯ��˾ 2004-02-11 CN claimed
US-20090253685-A1 Product comprising at least one Cdc25 phosphatase inhibitor in combination with at least one other anti-cancer agent SOCIETE DE CONSEILS DE RECHERCHES ET D' APPLICATIONS SCIENTIFICQUES 2009-10-08 US disclosed
US-20090137596-A1 G-PROTEIN INHIBITOR SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 2009-05-28 US disclosed
CN-100406449-C CDC25 phosphatase inhibitors SOD CONSEILS RECH APPLIC (FR) 2008-07-30 CN disclosed
US-7196084-B2 Cdc25 phosphatase inhibitors SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 2007-03-27 US disclosed
US-20060281736-A1 Product comprising at least one phosphatase cdc25 inhibitor combined with at least one other anticancer agent SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 2006-12-14 US disclosed
US-20060235027-A1 Inhibitors of cdc25 phosphatases SCRAS 2006-10-19 US disclosed
US-20060154933-A1 Inhibitors of Cdc25 phosphatases SCRAS 2006-07-13 US disclosed
US-20040034103-A1 Cdc25 photophatase inhibitors IPSEN PHARMA S.A.S. (FR) 2004-02-19 US disclosed
CN-1474689-A CDC25 phosphatase inhibitors ��ѧ�о���Ӧ����ѯ��˾ 2004-02-11 CN 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 (6 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-20040034103-A1 Cdc25 photophatase inhibitors CDC25C, CDC25A, CDC25B POLA1 178/4885AKR1B10 2561/4885AKR1B1 1479/4885
US-20090137596-A1 G-PROTEIN INHIBITOR CDC25A, CDC25C, CDC25B POLA1 473/4885AKR1B10 3074/4885AKR1B1 1833/4885
US-20060154933-A1 Inhibitors of Cdc25 phosphatases CDC25A, CDC25C, CDC25B POLA1 1114/4885AKR1B10 4282/4885AKR1B1 3944/4885
US-20060281736-A1 Product comprising at least one phosphatase cdc25 inhibitor combined with at least one other anticancer agent CDC25A, CDC25C, CDC25B POLA1 406/4885AKR1B10 2621/4885AKR1B1 1307/4885
US-20060235027-A1 Inhibitors of cdc25 phosphatases CDC25A, CDC25C, CDC25B POLA1 1114/4885AKR1B10 4282/4885AKR1B1 3944/4885
US-20090253685-A1 Product comprising at least one Cdc25 phosphatase inhibitor in combination with at least one other anti-cancer agent CDC25A, CDC25C, CDC25B POLA1 297/4885AKR1B10 3141/4885AKR1B1 1906/4885

“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.