SCHEMBL31472626

SCHEMBL31472626

Cc1ccc(C(=O)N[C@H]2CC3C=CC2C3)cc1C

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ GLA P06280 1/20 0.47
▸ GAA P10253 3/20 0.46
▸ NPC1 O15118 3/20 0.44
▸ RAB9A P51151 3/20 0.44
▸ EPHX2 P34913 5/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ HTT P42858 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.42
▸ KMT2A Q03164 2/20 0.40
▸ RECQL P46063 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ KCNQ3 O43525 1/20 0.39
▸ KCNQ2 O43526 1/20 0.39

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
SCHEMBL31472619 0.84 GAA (0.52) GAANPC1RAB9AEPHX2ALDH1A1
SCHEMBL31472629 0.82 NPC1 (0.53) GAANPC1RAB9AHTTKMT2A
SCHEMBL31472623 0.80 GAA (0.53) GAANPC1RAB9AEPHX2ALDH1A1
SCHEMBL31472635 0.78 GAA (0.52) GAANPC1RAB9AEPHX2ALDH1A1
SCHEMBL31472633 0.78 GAA (0.52) GAANPC1RAB9AEPHX2ALDH1A1
SCHEMBL31472630 0.78 GAA (0.54) GAANPC1RAB9AEPHX2ALDH1A1
SCHEMBL31472622 0.78 GAA (0.54) GAANPC1RAB9AEPHX2ALDH1A1
SCHEMBL31472627 0.78 EPHX2 (0.50) GAANPC1RAB9AEPHX2ALDH1A1
SCHEMBL31472628 0.78 EPHX2 (0.50) GAANPC1RAB9AEPHX2ALDH1A1
SCHEMBL31472618 0.77 GRM5 (0.56) GAANPC1RAB9AKMT2AMEN1

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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