SCHEMBL20159585

SCHEMBL20159585

Cc1nnc(N2CC3CC(C2)C3N)o1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PSEN1 P49768 10/20 0.34
▸ PSEN2 P49810 10/20 0.34
▸ APH1B Q8WW43 10/20 0.34
▸ NCSTN Q92542 10/20 0.34
▸ APH1A Q96BI3 10/20 0.34
▸ PSENEN Q9NZ42 10/20 0.34
▸ APP P05067 4/20 0.33
▸ RIPK1 Q13546 2/20 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
SCHEMBL18971166 0.90 PSEN1 (0.38) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL18971164 0.90 PSEN1 (0.38) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL21050393 0.90 PSEN1 (0.38) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL18952804 0.90 PSEN1 (0.38) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL18952715 0.90 PSEN1 (0.38) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL23504794 0.78 RIPK1 (0.32) RIPK1
SCHEMBL2276427 0.71 RIPK1 (0.42) RIPK1
SCHEMBL24921382 0.71 CHRM3 (0.35) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL21050360 0.69 PSEN1 (0.43) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL21050361 0.69 PSEN1 (0.43) PSEN1PSEN2APH1BNCSTNAPH1A

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-2018087018-A1 PHENOXYTRIAZOLES F. HOFFMANN-LA ROCHE AG (CH) 2018-05-17 — — WO disclosed
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