SCHEMBL28819247

SCHEMBL28819247

Cc1ccc(C=CC(=O)C=Cc2ccc(OCC(=O)N3CCN(S(=O)(=O)c4cccc(C(F)(F)F)c4)CC3)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.54
GAA P10253 4/20 0.49
GPR183 P32249 3/20 0.49
TSHR P16473 1/20 0.49
PKM P14618 4/20 0.48
ALDH1A1 P00352 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
MAPT P10636 1/20 0.47
HTT P42858 1/20 0.47
KMT2A Q03164 1/20 0.47

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
SCHEMBL28819242 0.93 LMNA (0.58) LMNAGAAGPR183TSHRPKM
SCHEMBL28819261 0.88 GPR183 (0.52) LMNAGAAGPR183TSHRPKM
SCHEMBL28819229 0.84 PKM (0.59) LMNAGAAGPR183PKMALDH1A1
SCHEMBL28819245 0.82 LMNA (0.52) LMNAGPR183PKMALDH1A1SMN1; SMN2
SCHEMBL28819260 0.79 PKM (0.53) LMNAGAAGPR183PKMALDH1A1
SCHEMBL28819253 0.76 LMNA (0.79) LMNAGPR183PKMALDH1A1SMN1; SMN2
SCHEMBL28948647 0.75 PKM (0.76) LMNAGPR183TSHRPKMALDH1A1
SCHEMBL28819254 0.74 GPR183 (0.70) LMNAGPR183PKMALDH1A1SMN1; SMN2
SCHEMBL28819240 0.74 PKM (0.81) LMNAGAAGPR183PKMALDH1A1
SCHEMBL9950592 0.74 GAA (0.67) LMNAGAAPKMALDH1A1SMN1; 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-114634465-A Sulfonyl piperazine-containing pentadiene ketone derivative and preparation method and application thereof 贵州大学 2022-06-17 CN disclosed