SCHEMBL4964192

SCHEMBL4964192

CCOC(=O)/C(C(=O)c1cccc2ccccc12)=C(\N)c1ccc(I)cc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CDC25B P30305 3/20 0.46
ALDH1A1 P00352 4/20 0.41
KDM4E B2RXH2 1/20 0.41
CDC25A P30304 1/20 0.41
CDC25C P30307 1/20 0.41
KMT2A Q03164 4/20 0.39
MEN1 O00255 3/20 0.39
HPGD P15428 2/20 0.39
NPC1 O15118 3/20 0.38
RAB9A P51151 2/20 0.38
CA12 O43570 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
PARP1 P09874 1/20 0.38
ATM Q13315 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
HSD17B10 Q99714 1/20 0.37

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
SCHEMBL4962298 0.89 CDC25B (0.46) CDC25BALDH1A1KDM4ECDC25ACDC25C
SCHEMBL3571420 0.84 MEN1 (0.41) ALDH1A1KMT2AMEN1HPGDNPC1
SCHEMBL3566831 0.84 CES2 (0.41) ALDH1A1KMT2AMEN1HPGDNPC1
SCHEMBL27663621 0.81 MEN1 (0.39) ALDH1A1KMT2AMEN1HSD17B10
SCHEMBL697232 0.77 CDC25B (0.63) CDC25BALDH1A1KDM4ECDC25ACDC25C
SCHEMBL4964197 0.74 DHODH (0.53) CDC25BALDH1A1KDM4ECDC25ACDC25C
SCHEMBL3566705 0.74 CES2 (0.43) ALDH1A1KDM4EKMT2AMEN1HPGD
SCHEMBL27798501 0.72 ALDH1A1 (0.59) CDC25BALDH1A1KDM4ECDC25ACDC25C
SCHEMBL28745462 0.72 CDC25B (0.57) CDC25BALDH1A1KDM4ECDC25ACDC25C
SCHEMBL3573848 0.72 LMNA (0.44) ALDH1A1KDM4EKMT2AMEN1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080064748-A1 Substituted enaminones, their derivatives and uses thereof OXFORD FINANCE CORPORATION 2008-03-13 US claimed

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-20080064748-A1 Substituted enaminones, their derivatives and uses thereof GABRB2, GABRB1, GABRB3 CDC25B 4622/4885ALDH1A1 423/4885KDM4E 2424/4885

“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.