SCHEMBL30821649

SCHEMBL30821649

OCCNCc1cccc(Oc2ccc(Cl)cc2)c1

nearest known ligand 0.70

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.54
▸ HTT P42858 3/20 0.51
▸ SMN1; SMN2 Q16637 3/20 0.51
▸ ALDH1A1 P00352 3/20 0.51
▸ KDM4E B2RXH2 2/20 0.51
▸ PPARG P37231 1/20 0.51
▸ PPARA Q07869 1/20 0.51
▸ MEN1 O00255 3/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ GAA P10253 1/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.48
▸ FDFT1 P37268 1/20 0.46
▸ DRD2 P14416 1/20 0.46
▸ DRD4 P21917 1/20 0.46
▸ CHRM2 P08172 2/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ ADRB3 P13945 1/20 0.44

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
SCHEMBL14149848 0.83 SMN1; SMN2 (0.54) LMNAHTTSMN1; SMN2ALDH1A1KDM4E
SCHEMBL5947523 0.83 CYP1A2 (0.56) HTTSMN1; SMN2ALDH1A1KDM4EFDFT1
SCHEMBL21634323 0.83 MEN1 (0.65) LMNAHTTSMN1; SMN2MEN1KMT2A
SCHEMBL13973310 0.82 ALDH1A1 (0.57) LMNAHTTSMN1; SMN2ALDH1A1KDM4E
SCHEMBL5947215 0.82 BCHE (0.62) LMNAHTTSMN1; SMN2ALDH1A1KDM4E
SCHEMBL21634276 0.81 MEN1 (0.62) LMNAHTTSMN1; SMN2MEN1KMT2A
SCHEMBL5312844 0.80 LMNA (0.60) LMNAALDH1A1PPARGPPARAFDFT1
SCHEMBL30821448 0.80 FFAR1 (0.61) LMNAHTTSMN1; SMN2ALDH1A1KDM4E
SCHEMBL30821586 0.80 KMT2A (0.51) LMNAHTTSMN1; SMN2ALDH1A1KDM4E
SCHEMBL2356108 0.80 LMNA (0.59) LMNAALDH1A1PPARGPPARAFDFT1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112424160-B Novel P62 ligand compound and composition for preventing, improving or treating protein conformational diseases comprising the same 奧土择破利悟株式会社 2024-03-08 — — CN claimed
CN-112424160-B Novel P62 ligand compound and composition for preventing, improving or treating protein conformational diseases comprising the same 奧土择破利悟株式会社 2024-03-08 — — CN disclosed
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