SCHEMBL23912838

SCHEMBL23912838

C=C(C)Nc1cc(-c2cnc(N)c(C(=O)N3CCCC3)c2)ccn1

nearest known ligand 0.84

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PIK3C3 Q8NEB9 20/20 0.84

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
SCHEMBL16996837 0.91 PIK3C3 (1.00) PIK3C3
SCHEMBL16996836 0.90 PIK3C3 (0.98) PIK3C3
SCHEMBL16926409 0.89 PIK3C3 (0.96) PIK3C3
SCHEMBL16926856 0.89 PIK3C3 (0.67) PIK3C3
SCHEMBL23912771 0.85 PIK3C3 (0.77) PIK3C3
SCHEMBL16926405 0.83 PIK3C3 (1.00) PIK3C3
SCHEMBL23912746 0.83 PIK3C3 (0.73) PIK3C3
SCHEMBL16990823 0.82 PIK3C3 (1.00) PIK3C3
SCHEMBL16926853 0.81 PIK3C3 (0.81) PIK3C3
SCHEMBL16926523 0.81 PIK3C3 (0.70) PIK3C3

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
EP-3094325-B1 HETEROARYLS AND USES THEREOF TAKEDA PHARMACEUTICALS CO (JP) 2021-10-13 EP disclosed