SCHEMBL869366

SCHEMBL869366

Nc1cccc2occ(-c3ccc4c(c3F)CCN4)c12

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.36
NOTUM Q6P988 1/20 0.31
BCHE P06276 1/20 0.30
ACHE P22303 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
SCHEMBL870034 0.82 EIF2AK3 (0.35) NOTUMBCHEACHE
SCHEMBL29007917 0.69 NOTUM (0.46) PARP1NOTUMBCHEACHE
SCHEMBL126414 0.65 PARP1 (0.56) PARP1NOTUMBCHEACHE
SCHEMBL30686938 0.62 NOTUM (0.48) NOTUM
SCHEMBL1031679 0.62 NOTUM (0.48) NOTUM
SCHEMBL24651185 0.61 EIF2AK3 (0.36)
Hydrochloric Acid SCHEMBL550139 0.61 NOTUM (0.47) NOTUM
SCHEMBL23059970 0.60 EIF2AK3 (0.37)
SCHEMBL869108 0.60 EIF2AK3 (0.49)
Hydrochloric Acid SCHEMBL23042914 0.60 EIF2AK3 (0.48)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120077828-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE LLC 2012-03-29 US 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-20120077828-A1 CHEMICAL COMPOUNDS BRCA1, IRS1, IGF1R PARP1 431/4885NOTUM 2790/4885BCHE 2482/4885

“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.