SCHEMBL6072327

SCHEMBL6072327

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

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE1A P54750 1/20 0.33
PDE1B Q01064 1/20 0.33
PDE1C Q14123 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
IRAK4 Q9NWZ3 2/20 0.31
FFAR4 Q5NUL3 2/20 0.31
S1PR1 P21453 1/20 0.30
EZH2 Q15910 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL6072461 0.91 FFAR4 (0.34) PDE1APDE1BPDE1CFFAR4EZH2
Hydrochloric Acid SCHEMBL6072214 0.90 TDP1 (0.32) TDP1IRAK4FFAR4EZH2MAPT
SCHEMBL6071808 0.90 GAA (0.33) TDP1IRAK4FFAR4EZH2MAPT
SCHEMBL6072481 0.90 IDO1 (0.33) TDP1IRAK4FFAR4MAPT
SCHEMBL6072106 0.90 IDO1 (0.33) TDP1IRAK4FFAR4S1PR1MAPT
SCHEMBL6071599 0.89 TDP1 (0.32) TDP1IRAK4FFAR4
Hydrochloric Acid SCHEMBL6071761 0.89 GAA (0.33) TDP1IRAK4FFAR4MAPT
Hydrochloric Acid SCHEMBL6072515 0.89 TDP1 (0.32) TDP1IRAK4FFAR4
SCHEMBL6072201 0.88 TDP1 (0.39) TDP1IRAK4MAPT
SCHEMBL6072104 0.87 FFAR4 (0.33) TDP1IRAK4FFAR4

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 PDE1A 168/4885PDE1B 100/4885PDE1C 189/4885

“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.