SCHEMBL38665543

SCHEMBL38665543

COc1ccc(C(N)(C(=O)OCc2cccc3c2Cc2ccccc2-3)c2ccc(OCC(=O)Nc3cccc(N)c3C)cc2)c(OC)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 5/20 0.40
▸ NPC1 O15118 3/20 0.40
▸ MAPT P10636 6/20 0.39
▸ TP53 P04637 2/20 0.39
▸ RXFP1 Q9HBX9 1/20 0.39
▸ TSHR P16473 2/20 0.38
▸ USP2 O75604 1/20 0.38
▸ KDM4E B2RXH2 3/20 0.37
▸ RECQL P46063 1/20 0.37
▸ MAPK10 P53779 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ KMT2A Q03164 5/20 0.37
▸ NPSR1 Q6W5P4 3/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ GAA P10253 2/20 0.37
▸ LMNA P02545 1/20 0.37
▸ MEN1 O00255 4/20 0.36
▸ PKM P14618 1/20 0.36
▸ HCAR2 Q8TDS4 1/20 0.35

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
SCHEMBL30381152 0.93 RAB9A (0.40) RAB9ANPC1MAPTTP53RXFP1
SCHEMBL26123782 0.87 RAB9A (0.40) RAB9ANPC1MAPTTP53TSHR
SCHEMBL14714715 0.84 RAB9A (0.36) RAB9ANPC1MAPTTSHRKDM4E
SCHEMBL29714449 0.83 NPC1 (0.35) RAB9ANPC1MAPTKDM4ESMN1; SMN2
SCHEMBL29387123 0.82 MAPT (0.34) RAB9ANPC1MAPTKDM4ESMN1; SMN2
SCHEMBL28831144 0.81 NPC1 (0.35) RAB9ANPC1MAPTKDM4ESMN1; SMN2
SCHEMBL31075128 0.76 ALDH1A1 (0.32) RAB9ANPC1KDM4ESMN1; SMN2ALDH1A1
SCHEMBL29385536 0.68 KMT2A (0.43) RAB9ANPC1MAPTTP53TSHR
SCHEMBL29521535 0.67 MEN1 (0.49) RAB9ANPC1MAPTTP53TSHR
SCHEMBL8752790 0.66 NPC1 (0.41) RAB9ANPC1TSHRSMN1; SMN2KMT2A

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-116999565-B Multiple small nucleic acid delivery system and multiple target vaccine 四川大学 2026-05-19 — — CN disclosed
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