SCHEMBL6316398

SCHEMBL6316398

N#CCC(=O)NC1CCN(Cc2ccccc2)CC1

nearest known ligand 0.73

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 18/20 0.73
POLB P06746 1/20 0.64
L3MBTL1 Q9Y468 1/20 0.64

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
SCHEMBL5862113 0.85 SIGMAR1 (1.00) SIGMAR1
SCHEMBL5124505 0.83 SIGMAR1 (0.81) SIGMAR1POLBL3MBTL1
SCHEMBL29640480 0.83 SIGMAR1 (0.81) SIGMAR1POLBL3MBTL1
SCHEMBL3075354 0.83 SIGMAR1 (0.81) SIGMAR1POLBL3MBTL1
SCHEMBL6177317 0.82 SIGMAR1 (0.79) SIGMAR1POLBL3MBTL1
SCHEMBL4844753 0.82 SIGMAR1 (0.79) SIGMAR1POLBL3MBTL1
SCHEMBL7268908 0.82 SIGMAR1 (0.79) SIGMAR1POLBL3MBTL1
SCHEMBL2425554 0.82 SIGMAR1 (0.78) SIGMAR1POLBL3MBTL1
Hydrochloric Acid SCHEMBL31462260 0.81 SIGMAR1 (0.77) SIGMAR1POLBL3MBTL1
Hydrochloric Acid SCHEMBL29640479 0.81 SIGMAR1 (0.77) SIGMAR1POLBL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020249821-A1 NOVEL ARGINASE INHIBITORS RIJKSUNIVERSITEIT GRONINGEN (NL) 2020-12-17 WO disclosed
US-20050059657-A1 Aminoisoxazole derivatives active as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2005-03-17 US disclosed
EP-1435948-A1 AMINOISOXAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS Pharmacia Italia S.p.A. (IT) 2004-07-14 EP disclosed
WO-2003013517-A1 AMINOISOXAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS PHARMACIA ITALIA S.P.A. (IT) 2003-02-20 WO 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-20050059657-A1 Aminoisoxazole derivatives active as kinase inhibitors MAP3K9, MAP3K19, MAP4K2 SIGMAR1 4718/4885POLB 872/4885L3MBTL1 4176/4885

“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.