SCHEMBL4903709

SCHEMBL4903709

COC(=O)c1ccc(-c2cn(Cc3ccccc3)c(=O)n2Cc2ccc(CP(=O)(OF)OF)c(Br)c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK10 P53779 4/20 0.42
ALDH1A1 P00352 1/20 0.42
MAPK8 P45983 3/20 0.41
KDM4E B2RXH2 1/20 0.38
HIF1A Q16665 1/20 0.37
MMP13 P45452 1/20 0.37
CNR2 P34972 2/20 0.36
USP2 O75604 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CHRM4 P08173 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
DRD2 P14416 1/20 0.36
TBXA2R P21731 1/20 0.36

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
SCHEMBL4901331 1.00 MAPK10 (0.42) MAPK10ALDH1A1MAPK8KDM4EHIF1A
SCHEMBL4895554 0.97 MAPK8 (0.43) MAPK10ALDH1A1MAPK8KDM4EHIF1A
SCHEMBL4900023 0.93 MAPK10 (0.40) MAPK10ALDH1A1MAPK8HIF1AUSP2
SCHEMBL4892739 0.93 KDM4E (0.47) MAPK10ALDH1A1MAPK8KDM4EL3MBTL1
SCHEMBL4901582 0.92 F2RL3 (0.43) MAPK10ALDH1A1KDM4EL3MBTL1MEN1
SCHEMBL4895489 0.92 ALDH1A1 (0.39) MAPK10ALDH1A1MAPK8MMP13L3MBTL1
SCHEMBL4898669 0.92 ALDH1A1 (0.39) MAPK10ALDH1A1MAPK8MMP13L3MBTL1
SCHEMBL4899991 0.91 KLKB1 (0.39) MAPK10ALDH1A1MAPK8MMP13CNR2
SCHEMBL4890554 0.91 MAPK10 (0.38) MAPK10ALDH1A1MAPK8HIF1AUSP2
SCHEMBL4894160 0.91 MAPK10 (0.38) MAPK10ALDH1A1MAPK8KDM4EHIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080070867-A1 2-Imidazolone and 2-Imidazolidinone Heterocyclic Inhibitors of Tyrosine Phosphatases METABASIS THERAPEUTICS, INC. (US) 2008-03-20 US claimed
WO-2006078698-A1 2-IMIDAZOLONE AND 2-IMIDAZOLIDINONE HETEROCYCLIC INHIBITORS OF TYROSINE PHOSPHATASES CENGENT THERAPEUTICS, INC. (US) 2006-07-27 WO claimed
US-20080070867-A1 2-Imidazolone and 2-Imidazolidinone Heterocyclic Inhibitors of Tyrosine Phosphatases METABASIS THERAPEUTICS, INC. (US) 2008-03-20 US disclosed
WO-2006078698-A1 2-IMIDAZOLONE AND 2-IMIDAZOLIDINONE HETEROCYCLIC INHIBITORS OF TYROSINE PHOSPHATASES CENGENT THERAPEUTICS, INC. (US) 2006-07-27 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-20080070867-A1 2-Imidazolone and 2-Imidazolidinone Heterocyclic Inhibitors of Tyrosine Phosphatases PPM1B, PPM1D, PTPRS MAPK10 656/4885ALDH1A1 3704/4885MAPK8 682/4885

“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.