SCHEMBL4122710

SCHEMBL4122710

COc1c(F)cccc1C(=O)c1cc(Cl)ccc1-n1cccc1C=O

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.42
CYP1A2 P05177 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HCRTR2 O43614 7/20 0.36
HCRTR1 O43613 5/20 0.36
CYP11B1 P15538 1/20 0.35
CYP11B2 P19099 1/20 0.35

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
SCHEMBL4123934 0.91 GAA (0.51) GAACYP1A2L3MBTL1ALDH1A1
SCHEMBL4132493 0.89 HCRTR2 (0.34) HCRTR2HCRTR1
SCHEMBL4132499 0.89 HCRTR2 (0.34) HCRTR2HCRTR1
SCHEMBL4110400 0.87 GAA (0.49) GAACYP1A2L3MBTL1ALDH1A1
SCHEMBL4117949 0.86 GAA (0.46) GAACYP1A2L3MBTL1ALDH1A1
SCHEMBL4133055 0.84 GAA (0.46) GAACYP1A2L3MBTL1ALDH1A1
SCHEMBL4118295 0.84 GAA (0.56) GAACYP1A2L3MBTL1ALDH1A1CYP11B1
SCHEMBL13776370 0.83 PTGS1 (0.36) ALDH1A1HCRTR2HCRTR1
SCHEMBL4110749 0.81 GAA (0.39) GAA
SCHEMBL4118982 0.81 LMNA (0.41) L3MBTL1ALDH1A1HCRTR2HCRTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090181942-A1 TRICYCLIC COMPOUNDS DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-07-16 US disclosed
US-20090181942-A1 TRICYCLIC COMPOUNDS DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-07-16 US disclosed
EP-1939205-A1 TRICYCLIC COMPOUND Daiichi Sankyo Company, Limited (JP) 2008-07-02 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-20090181942-A1 TRICYCLIC COMPOUNDS FDFT1, COASY, HMGCR GAA 922/4885CYP1A2 352/4885L3MBTL1 661/4885

“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.