SCHEMBL16410785

SCHEMBL16410785

Clc1cc2c(cc1Cl)NC1(CCOCC1)C(NNCc1ccccc1)=N2

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PIK3CB P42338 1/20 0.31

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
SCHEMBL16410858 0.91 PIK3CA (0.35) PIK3CB
SCHEMBL17758076 0.89 PIK3CB (0.36) PIK3CB
SCHEMBL16410792 0.89 KMT2A (0.38) —
SCHEMBL16410700 0.88 ACAT2 (0.38) —
SCHEMBL16410806 0.84 PIK3CB (0.30) PIK3CB
SCHEMBL16410629 0.82 PIK3CA (0.36) PIK3CB
SCHEMBL17757055 0.80 PIK3CA (0.40) PIK3CB
SCHEMBL17758090 0.78 KCNN3 (0.36) PIK3CB
SCHEMBL16410758 0.78 KMT2A (0.36) —
SCHEMBL16410624 0.78 SMN1; SMN2 (0.38) —

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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