SCHEMBL10285827

SCHEMBL10285827

CC(C)=CC(=O)N1CC[C@H](C)C1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.44
▸ ALDH1A1 P00352 7/20 0.41
▸ NPC1 O15118 2/20 0.41
▸ HPGD P15428 3/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ POLB P06746 2/20 0.38
▸ MAPT P10636 1/20 0.38
▸ ACHE P22303 1/20 0.37
▸ DPP4 P27487 1/20 0.36
▸ DPP8 Q6V1X1 1/20 0.36
▸ DPP7 Q9UHL4 1/20 0.36
▸ RECQL P46063 1/20 0.36
▸ GAA P10253 2/20 0.36
▸ PHGDH O43175 1/20 0.35
▸ MGLL Q99685 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
SCHEMBL26880353 0.88 ALDH1A1 (0.48) LMNAALDH1A1NPC1HPGDRAB9A
SCHEMBL22826051 0.82 DPP4 (0.44) LMNAALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL15726987 0.80 ALDH1A1 (0.41) LMNAALDH1A1NPC1HPGDRAB9A
SCHEMBL15080935 0.80 ALDH1A1 (0.41) LMNAALDH1A1NPC1HPGDRAB9A
SCHEMBL1687958 0.80 ALDH1A1 (0.41) LMNAALDH1A1NPC1HPGDRAB9A
SCHEMBL478542 0.79 — —
SCHEMBL12142184 0.79 — —
SCHEMBL4760538 0.79 — —
SCHEMBL23997789 0.78 ALDH1A1 (0.47) LMNAALDH1A1NPC1HPGDRAB9A
SCHEMBL19629191 0.77 ALDH1A1 (0.39) LMNAALDH1A1NPC1HPGDRAB9A

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
WO-2012035055-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2012-03-22 — — WO disclosed
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