SCHEMBL31472627

SCHEMBL31472627

COc1ccc(C(=O)N[C@H]2CC3C=CC2C3)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 2/20 0.50
▸ GAA P10253 2/20 0.49
▸ SSTR3 P32745 2/20 0.48
▸ CA1 P00915 2/20 0.47
▸ CA2 P00918 2/20 0.47
▸ PLK1 P53350 1/20 0.47
▸ CNR2 P34972 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ F10 P00742 1/20 0.46
▸ GRM2 Q14416 1/20 0.46
▸ GRM3 Q14832 1/20 0.46
▸ NAAA Q02083 1/20 0.45
▸ NPC1 O15118 2/20 0.45
▸ RAB9A P51151 2/20 0.45
▸ TP53 P04637 1/20 0.45
▸ ALOX15 P16050 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ GRM5 P41594 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
SCHEMBL31472628 1.00 EPHX2 (0.50) EPHX2GAASSTR3CA1CA2
SCHEMBL31472634 0.86 MEN1 (0.52) EPHX2GAAL3MBTL1SMN1; SMN2ALDH1A1
SCHEMBL31472625 0.84 GRM5 (0.52) GAACNR2GRM2GRM3NPC1
SCHEMBL31472619 0.84 GAA (0.52) EPHX2GAASSTR3NPC1RAB9A
SCHEMBL31472623 0.82 GAA (0.53) EPHX2GAASSTR3GRM2GRM3
SCHEMBL31472635 0.81 GAA (0.52) EPHX2GAAL3MBTL1F10GRM2
SCHEMBL31472633 0.81 GAA (0.52) EPHX2GAAL3MBTL1F10GRM2
SCHEMBL31472630 0.81 GAA (0.54) EPHX2GAAL3MBTL1NPC1RAB9A
SCHEMBL31472622 0.81 GAA (0.54) EPHX2GAAL3MBTL1NPC1RAB9A
SCHEMBL22617482 0.79 GAA (0.53) EPHX2GAAALDH1A1

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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