SCHEMBL3484884

SCHEMBL3484884

Nc1ccc(Oc2ccc3c(c2)NC(=O)C3)c(Cl)c1

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EIF2AK2 P19525 1/20 0.62
AHR P35869 5/20 0.49
CMA1 P23946 2/20 0.49
EGFR P00533 2/20 0.49
ERBB2 P04626 2/20 0.49
CA9 Q16790 1/20 0.44
PDE7A Q13946 1/20 0.41
MAOB P27338 2/20 0.39
TDP2 O95551 2/20 0.38
FFAR1 O14842 1/20 0.37
HTR2A P28223 1/20 0.37
SLC6A4 P31645 1/20 0.37
PDK2 Q15119 1/20 0.36
PNLIP P16233 1/20 0.36
DRD2 P14416 1/20 0.35
CRBN Q96SW2 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
SCHEMBL3484612 0.90 MAOB (0.50) EIF2AK2AHRCMA1EGFRERBB2
SCHEMBL3483943 0.81 EIF2AK2 (0.57) EIF2AK2AHRCMA1EGFRERBB2
SCHEMBL397588 0.79 EIF2AK2 (0.74) EIF2AK2AHRCMA1CA9MAOB
SCHEMBL30468520 0.77 CA9 (0.70) EIF2AK2AHRCMA1CA9TDP2
SCHEMBL398137 0.77 CA9 (0.70) EIF2AK2AHRCMA1CA9TDP2
Hydrochloric Acid SCHEMBL9833199 0.75 CA9 (0.68) EIF2AK2AHRCMA1CA9TDP2
SCHEMBL3484815 0.74 EGFR (0.49) AHRCMA1EGFRERBB2CA9
SCHEMBL3484193 0.74 EGFR (0.49) EGFRERBB2CA9PDE7AHTR2A
SCHEMBL3484676 0.74 AHR (0.56) AHREGFRERBB2TDP2
Methylamine SCHEMBL28015139 0.74 CA9 (0.66) EIF2AK2AHRCMA1CA9TDP2

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 EIF2AK2 1327/4885AHR 259/4885CMA1 2939/4885

“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.