SCHEMBL28484376

SCHEMBL28484376

CC1C(C(CCCCOC(=O)CC(=O)OCCCCC(c2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)C2CC(C)(C)N(C)C(C)C2C)c2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)CC(C)(C)N(C)C1C

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.31
KCNH2 Q12809 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL22260996 0.83 GAA (0.33) GAAKCNH2MEN1KMT2A
SCHEMBL28484380 0.79 MEN1 (0.32) GAAMEN1KMT2A
SCHEMBL28473322 0.77 GAA (0.33) GAAKCNH2MEN1KMT2A
SCHEMBL224190 0.72 GAA (0.33) GAA
SCHEMBL29612236 0.70 GAA (0.34) GAAMEN1KMT2A
SCHEMBL21239974 0.70 IDH1 (0.33) GAA
SCHEMBL19118382 0.67 HMGCR (0.35) GAAKCNH2MEN1KMT2A
SCHEMBL2319233 0.66 NR5A2 (0.35) GAA
SCHEMBL4556029 0.64 CNR1 (0.31)
SCHEMBL28473326 0.64 GAA (0.36) GAAKCNH2MEN1KMT2A

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-114790328-A Alicyclic polycarbonate composition 华东理工大学 2022-07-26 CN disclosed
CN-108603018-B Polycarbonate resin composition and molded article thereof 三菱化学株式会社 2020-08-14 CN disclosed