SCHEMBL3484612

SCHEMBL3484612

Nc1ccc(Oc2ccc3c(c2)CC(=O)N3)c(Cl)c1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.50
AHR P35869 2/20 0.49
EGFR P00533 2/20 0.49
ERBB2 P04626 2/20 0.49
EIF2AK2 P19525 1/20 0.48
GRIA1 P42261 2/20 0.42
CACNG8 Q8WXS5 2/20 0.42
PGR P06401 1/20 0.42
PDE7A Q13946 1/20 0.41
BCL6 P41182 1/20 0.40
GAA P10253 3/20 0.40
CRBN Q96SW2 1/20 0.39
CMA1 P23946 1/20 0.39
MAPT P10636 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
PDE3B Q13370 1/20 0.39
PDE3A Q14432 1/20 0.39

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
SCHEMBL3484884 0.90 EIF2AK2 (0.62) MAOBAHREGFRERBB2EIF2AK2
SCHEMBL11094738 0.83 MAOB (0.53) MAOBAHREGFRERBB2EIF2AK2
SCHEMBL5638486 0.82 EIF2AK2 (0.61) MAOBAHREIF2AK2GRIA1CACNG8
SCHEMBL9581631 0.81 KIF11 (0.56) MAOBAHREGFRERBB2EIF2AK2
SCHEMBL3484160 0.81 PDE7A (0.55) MAOBAHREGFRERBB2EIF2AK2
SCHEMBL22660 0.77 AHR (0.61) AHREIF2AK2GRIA1CACNG8PGR
SCHEMBL11089100 0.76 AHR (0.68) MAOBAHREIF2AK2GRIA1CACNG8
Hydrochloric Acid SCHEMBL15206761 0.75 AHR (0.59) AHREIF2AK2GRIA1CACNG8PGR
Bromide SCHEMBL9824774 0.75 AHR (0.59) AHREIF2AK2GRIA1CACNG8PGR
SCHEMBL3484815 0.74 EGFR (0.49) AHREGFRERBB2GRIA1CACNG8

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-20100004238-A1 FUSED HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-01-07 US disclosed
CN-101611041-A Condensed heterocyclic compouds TAKEDA PHARMACEUTICAL (JP) 2009-12-23 CN disclosed
EP-2103620-A1 FUSED HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2009-09-23 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-20100004238-A1 FUSED HETEROCYCLIC COMPOUND ERBB2, ROS1, FLT3 MAOB 847/4885AHR 259/4885EGFR 13/4885

“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.