SCHEMBL4594364

SCHEMBL4594364

COC(=O)c1ccc(Nc2ccc(OC)c3ccccc23)cc1

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CDC25B P30305 5/20 0.62
SIRT2 Q8IXJ6 1/20 0.58
KDM4E B2RXH2 1/20 0.53
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
MAPT P10636 3/20 0.49
AKR1C4 P17516 1/20 0.48
AKR1C3 P42330 1/20 0.48
AKR1C2 P52895 1/20 0.48
AKR1C1 Q04828 1/20 0.48
PDE5A O76074 1/20 0.48
ABCC1 P33527 1/20 0.48
ABCG2 Q9UNQ0 1/20 0.48
FABP4 P15090 1/20 0.48
ALOX15 P16050 1/20 0.48
TSHR P16473 1/20 0.46
CDC25A P30304 1/20 0.46
PLK1 P53350 1/20 0.46

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
SCHEMBL4593706 0.89 CDC25B (0.74) CDC25BMEN1KMT2AAKR1C3AKR1C2
SCHEMBL4594777 0.85 SIRT2 (0.57) CDC25BSIRT2KDM4EMEN1KMT2A
SCHEMBL14030692 0.83 CDC25B (0.63) CDC25BMEN1KMT2AMAPTAKR1C4
SCHEMBL4594920 0.81 CDC25B (0.67) CDC25BKDM4EMEN1KMT2AMAPT
SCHEMBL4594590 0.80 RAB9A (0.64) CDC25BKDM4EMEN1KMT2AMAPT
SCHEMBL14048484 0.80 CDC25B (0.55) CDC25BKDM4EMEN1KMT2AMAPT
SCHEMBL4594357 0.79 RAB9A (0.63) CDC25BSIRT2KDM4EMEN1KMT2A
SCHEMBL4594746 0.78 KDM4E (0.54) CDC25BSIRT2KDM4EMEN1KMT2A
SCHEMBL4594987 0.78 CDC25B (0.71) CDC25BKDM4EMEN1KMT2AMAPT
SCHEMBL4594901 0.76 KDM4E (0.58) CDC25BSIRT2KDM4EMEN1KMT2A

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-20080255232-A1 Naphthyl Derivatives as Inhibitors of Beta-Amyloid Aggregation SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2008-10-16 US disclosed
US-20080255232-A1 Naphthyl Derivatives as Inhibitors of Beta-Amyloid Aggregation SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2008-10-16 US disclosed
EP-1937243-A2 NAPHTHYL DERIVATIVES AS INHIBITORS OF BETA-AMYLOID AGGREGATION SIGMA-TAU Industrie Farmaceutiche Riunite S.p.A. (IT) 2008-07-02 EP disclosed
WO-2007045593-A2 NAPHTHYL DERIVATIVES AS INHIBITORS OF BETA-AMYLOID AGGREGATION SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2007-04-26 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-20080255232-A1 Naphthyl Derivatives as Inhibitors of Beta-Amyloid Aggregation APP, BACE1, SNCA CDC25B 2914/4885SIRT2 2073/4885KDM4E 4789/4885

“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.