SCHEMBL28824398

SCHEMBL28824398

Nc1cc(COCC(F)(F)F)nc(CC2CC2)n1

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PDE2A O00408 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
SCHEMBL28159338 0.77 ALDH1A1 (0.31) —
SCHEMBL28043035 0.76 PIK3CA (0.33) —
SCHEMBL16398389 0.69 HTR2A (0.34) —
SCHEMBL16398164 0.66 FFAR1 (0.34) —
SCHEMBL16398055 0.65 IDH1 (0.42) —
SCHEMBL3934799 0.64 BACE1 (0.38) —
SCHEMBL16398534 0.63 NUDT1 (0.42) —
SCHEMBL16397929 0.61 MALT1 (0.37) —
SCHEMBL16397831 0.61 TACR1 (0.36) —
SCHEMBL4716506 0.61 HRH4 (0.38) PDE2A

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
CN-105263923-A Pyrimidine compounds and their use as gamma secretase modulators Acturum Life Science AB 2016-01-20 — — CN disclosed
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