SCHEMBL6072274

SCHEMBL6072274

CCOc1cc2c(c3c1OC(C)(C)C3)C(c1ccc(C(=O)OC)c(NCc3ccc4ccccc4n3)c1)=NC(C)(C)C2

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 1/20 0.37
ALOX5AP P20292 12/20 0.37
ABCG2 Q9UNQ0 7/20 0.36
ABCB1 P08183 2/20 0.34

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
SCHEMBL6072532 0.94 HDAC8 (0.36) HDAC8ALOX5AP
SCHEMBL6072118 0.90 ABCG2 (0.47) ABCG2ABCB1
SCHEMBL6071890 0.89 POLB (0.36)
SCHEMBL6071796 0.87 ALDH1A1 (0.35) ABCG2
SCHEMBL6071599 0.87 TDP1 (0.32)
SCHEMBL6071964 0.87 TSHR (0.38)
Hydrochloric Acid SCHEMBL6072515 0.86 TDP1 (0.32)
SCHEMBL6072201 0.85 TDP1 (0.39)
SCHEMBL6072340 0.85 MAPT (0.35) ABCG2ABCB1
SCHEMBL6071949 0.85 HDAC1 (0.38) HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060106048-A1 Furoisoquinoline derivative and use thereof PASCALI, PETROS P. (CY) 2006-05-18 US disclosed
EP-1541576-A1 FUROISOQUINOLINE DERIVATIVE AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2005-06-15 EP 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-20060106048-A1 Furoisoquinoline derivative and use thereof PDE3B, PDE2A, PDE3A HDAC8 539/4885ALOX5AP 2761/4885ABCG2 1561/4885

“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.