SCHEMBL28661668

SCHEMBL28661668

Fc1ccc(N2CCN(c3nc(-c4ccc5ccccc5c4)no3)CC2)cc1F

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 9/20 0.51
▸ GAA P10253 1/20 0.51
▸ THRB P10828 2/20 0.51
▸ TP53 P04637 3/20 0.43
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ LMNA P02545 2/20 0.41
▸ NR1H4 Q96RI1 6/20 0.41
▸ HTR3A P46098 1/20 0.41

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
SCHEMBL28930626 0.86 MAPT (0.68) MAPTGAATHRBTP53MEN1
SCHEMBL28665720 0.85 MAPT (0.54) MAPTGAATHRBTP53MEN1
SCHEMBL28688168 0.83 MAPT (0.53) MAPTGAATHRBTP53MEN1
SCHEMBL28665641 0.83 MAPT (0.58) MAPTGAATHRBTP53MEN1
SCHEMBL28681669 0.83 MAPT (0.56) MAPTGAATHRBTP53MEN1
SCHEMBL28667773 0.81 MAPT (0.62) MAPTGAATHRBTP53MEN1
SCHEMBL28680258 0.81 MAPT (0.53) MAPTGAATHRBTP53MEN1
SCHEMBL28667847 0.81 MAPT (0.56) MAPTGAATHRBTP53ALDH1A1
SCHEMBL28665714 0.81 MAPT (0.64) MAPTGAATHRBTP53MEN1
SCHEMBL28665638 0.79 MAPT (0.48) MAPTGAATHRBTP53

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-108658889-B 1,2, 4-oxadiazole-aryl piperazine compound containing naphthalene ring and preparation method and application thereof 贵州医科大学 2021-12-17 — — CN disclosed
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