SCHEMBL16410689

SCHEMBL16410689

NN1CCC2(CC1)Nc1c(Cl)cc(Cl)cc1N=C2NNCc1ccccc1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 1/20 0.32

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
SCHEMBL16410806 0.86 PIK3CB (0.30) —
SCHEMBL16410633 0.79 ACAT2 (0.37) —
SCHEMBL16410663 0.79 HTR1A (0.30) —
SCHEMBL16410538 0.78 KMT2A (0.32) —
SCHEMBL17757123 0.77 KMT2A (0.39) —
SCHEMBL17757799 0.76 ACAT2 (0.36) —
SCHEMBL17757102 0.75 PIK3CB (0.35) —
SCHEMBL16410737 0.74 ACAT2 (0.35) —
SCHEMBL16410754 0.72 KMT2A (0.37) —
SCHEMBL16410703 0.72 AKT2 (0.33) —

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
WO-2015007730-A1 SPIROQUINOXALINE DERIVATIVES AS INHIBITORS OF NON-APOPTOTIC REGULATED CELL-DEATH Helmholtz Zentrum München - Deutsches Forschungszentrum für Gesundheit und Umwelt (GmbH) (DE) 2015-01-22 — — WO disclosed
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