SCHEMBL5722947

SCHEMBL5722947

COc1ccc(C(Sc2ccncc2)c2ccccc2)c2c1OC(C)(C)C2

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
FFAR4 Q5NUL3 4/20 0.34
PDE4A P27815 6/20 0.32
PDE4D Q08499 3/20 0.32
PDE4B Q07343 2/20 0.32
PDE4C Q08493 2/20 0.32
LMNA P02545 2/20 0.30
MAPT P10636 1/20 0.30
CYP19A1 P11511 1/20 0.30
ALDH1A1 P00352 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
SCHEMBL5723227 0.76 FFAR4 (0.38) FFAR4PDE4APDE4DPDE4BPDE4C
SCHEMBL5723161 0.75 TDP1 (0.41) TDP1L3MBTL1PDE4APDE4DPDE4B
SCHEMBL5722864 0.71 FFAR4 (0.35) TDP1L3MBTL1FFAR4PDE4APDE4D
SCHEMBL5722956 0.69 FFAR4 (0.39) FFAR4PDE4APDE4DPDE4BPDE4C
SCHEMBL5722878 0.67 CYP19A1 (0.45) FFAR4PDE4APDE4DPDE4BPDE4C
SCHEMBL5722883 0.67 CYP19A1 (0.45) FFAR4PDE4APDE4DPDE4BPDE4C
SCHEMBL5722869 0.66 MAPT (0.50) FFAR4PDE4APDE4DPDE4BPDE4C
SCHEMBL5722875 0.66 MAPT (0.50) FFAR4PDE4APDE4DPDE4BPDE4C
SCHEMBL5722721 0.65 FFAR4 (0.36) FFAR4PDE4APDE4DPDE4BPDE4C
SCHEMBL12765037 0.64 ALDH1A1 (0.45) FFAR4PDE4APDE4DPDE4BPDE4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0771794-B1 OXYGEN-CONTAINING HETEROCYCLIC COMPOUNDS KYOWA HAKKO KOGYO KK (JP) 2006-05-03 EP disclosed
US-6716987-B1 PHOSPHODIESTERASE IV INHIBITORS KYOWA HAKKO KOGYO CO., LTD. (JP) 2004-04-06 US disclosed
US-6514996-B2 Derivatives of benzofuran or benzodioxole KYOWA HAKKO KOGYO CO., LTD. (JP) 2003-02-04 US disclosed
US-20020128290-A1 DERIVATIVES OF BENZOFURAN OR BENZODIOXOLE KYOWA HAKKO KOGYO CO., LTD. (JP) 2002-09-12 US disclosed
EP-0771794-A1 OXYGEN-CONTAINING HETEROCYCLIC COMPOUNDS KYOWA HAKKO KOGYO CO., LTD. (JP) 1997-05-07 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-20020128290-A1 DERIVATIVES OF BENZOFURAN OR BENZODIOXOLE CBR1, CBR3, CYC1 TDP1 1138/4885L3MBTL1 1489/4885FFAR4 2653/4885

“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.