SCHEMBL31472629

SCHEMBL31472629

Cc1cccc(C(=O)N[C@H]2CC3C=CC2C3)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.53
▸ RAB9A P51151 1/20 0.53
▸ HDAC8 Q9BY41 1/20 0.49
▸ HDAC6 Q9UBN7 1/20 0.49
▸ GAA P10253 2/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ KCNK3 O14649 1/20 0.46
▸ KCNH2 Q12809 1/20 0.46
▸ KCNK9 Q9NPC2 1/20 0.46
▸ LMNA P02545 2/20 0.45
▸ GRM5 P41594 1/20 0.45
▸ USP2 O75604 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ OPRK1 P41145 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
SCHEMBL31472618 0.84 GRM5 (0.56) NPC1RAB9AGAAMEN1KMT2A
SCHEMBL31472625 0.83 GRM5 (0.52) NPC1RAB9AGAASMN1; SMN2MEN1
SCHEMBL31472619 0.83 GAA (0.52) NPC1RAB9AHDAC6GAASMN1; SMN2
SCHEMBL31472630 0.83 GAA (0.54) NPC1RAB9AGAAMEN1KMT2A
SCHEMBL31472622 0.83 GAA (0.54) NPC1RAB9AGAAMEN1KMT2A
SCHEMBL31472626 0.82 GLA (0.47) NPC1RAB9AGAAMEN1KMT2A
SCHEMBL31472623 0.76 GAA (0.53) NPC1RAB9AGAAGRM5KDM4E
SCHEMBL31472621 0.74 EPHX2 (0.47) NPC1RAB9AGAALMNAGRM5
SCHEMBL31472633 0.74 GAA (0.52) NPC1RAB9AGAAMEN1KMT2A
SCHEMBL31472635 0.74 GAA (0.52) NPC1RAB9AGAAMEN1KMT2A

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-119504475-A N-alkylamine compound, preparation method and application 南阳师范学院 2025-02-25 — — CN disclosed
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