SCHEMBL31472625

SCHEMBL31472625

COc1cccc(C(=O)N[C@H]2CC3C=CC2C3)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 1/20 0.52
▸ MEN1 O00255 3/20 0.51
▸ KMT2A Q03164 3/20 0.51
▸ FAAH O00519 1/20 0.51
▸ CNR2 P34972 1/20 0.51
▸ ALDH1A1 P00352 3/20 0.51
▸ NPC1 O15118 6/20 0.50
▸ RAB9A P51151 6/20 0.50
▸ GRM6 O15303 1/20 0.49
▸ GRM2 Q14416 1/20 0.49
▸ GRM3 Q14832 1/20 0.49
▸ GRM4 Q14833 1/20 0.49
▸ TSHR P16473 3/20 0.48
▸ SMN1; SMN2 Q16637 3/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.47
▸ CES2 O00748 1/20 0.47
▸ CES1 P23141 1/20 0.47
▸ LMNA P02545 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ KCNK3 O14649 1/20 0.46

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
SCHEMBL31472634 0.87 MEN1 (0.52) MEN1KMT2AALDH1A1SMN1; SMN2NPSR1
SCHEMBL31472628 0.84 EPHX2 (0.50) GRM5CNR2ALDH1A1NPC1RAB9A
SCHEMBL31472627 0.84 EPHX2 (0.50) GRM5CNR2ALDH1A1NPC1RAB9A
SCHEMBL31472629 0.83 NPC1 (0.53) GRM5MEN1KMT2ANPC1RAB9A
SCHEMBL31472618 0.81 GRM5 (0.56) GRM5MEN1KMT2ANPC1RAB9A
SCHEMBL31472630 0.80 GAA (0.54) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL31472622 0.80 GAA (0.54) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL31472626 0.76 GLA (0.47) MEN1KMT2AALDH1A1NPC1RAB9A
SCHEMBL2468483 0.76 NPC1 (0.71) GRM5MEN1KMT2AALDH1A1NPC1
SCHEMBL4168334 0.74 TAS1R3 (0.74) GRM5MEN1KMT2AALDH1A1NPC1

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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