SCHEMBL28616300

SCHEMBL28616300

O=C(/C=C/c1ccc(Br)cc1)N1CCN(c2nc(-c3ccc4ccccc4c3)no2)CC1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ GPR183 P32249 17/20 0.51
▸ ALDH1A1 P00352 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ TP53 P04637 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ KCNH2 Q12809 2/20 0.45
▸ PTPN1 P18031 1/20 0.43

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
SCHEMBL28634881 0.92 GAA (0.48) GPR183LMNATP53SMN1; SMN2
SCHEMBL28617649 0.91 LMNA (0.48) GPR183ALDH1A1LMNATP53HPGD
SCHEMBL28620401 0.91 GPR183 (0.55) GPR183ALDH1A1LMNATP53KCNH2
SCHEMBL28620396 0.91 LMNA (0.48) GPR183LMNATP53HPGDKCNH2
SCHEMBL28617479 0.88 STAT3 (0.52) GPR183ALDH1A1LMNATP53HPGD
SCHEMBL28633212 0.87 ALDH1A1 (0.53) GPR183ALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL28620945 0.87 GPR183 (0.50) GPR183SMN1; SMN2
SCHEMBL28619727 0.87 CCNC (0.46) ALDH1A1LMNATP53SMN1; SMN2
SCHEMBL28615982 0.87 MAPT (0.52) GPR183ALDH1A1LMNATP53SMN1; SMN2
SCHEMBL28617767 0.85 L3MBTL1 (0.55) GPR183ALDH1A1LMNATP53SMN1; SMN2

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-108440440-B Naphthalene ring-containing 1,2, 4-oxadiazole-cinnamoyl piperazine compound and preparation method and application thereof 贵州医科大学 2021-07-13 — — CN disclosed
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