SCHEMBL18766901

SCHEMBL18766901

COc1cccc(CC2(N3CCC(CNC(=O)OC(C)(C)C)CC3)CC2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.46
▸ MEN1 O00255 6/20 0.44
▸ KMT2A Q03164 6/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ DRD2 P14416 2/20 0.43
▸ TGFBR1 P36897 1/20 0.43
▸ ACACB O00763 1/20 0.43
▸ LMNA P02545 2/20 0.42
▸ CKS1B P61024 1/20 0.42
▸ SKP1 P63208 1/20 0.42
▸ SKP2 Q13309 1/20 0.42
▸ CACNA1B Q00975 1/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ GAA P10253 2/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ GNRHR P30968 1/20 0.41

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
SCHEMBL29725632 0.83 MEN1 (0.57) MAPTMEN1KMT2ADRD2ALDH1A1
SCHEMBL18766902 0.82 MEN1 (0.46) MAPTMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL18768210 0.82 ACACB (0.47) MAPTMEN1KMT2ASMN1; SMN2DRD2
SCHEMBL18766905 0.82 KMT2A (0.54) MAPTMEN1KMT2ADRD2TGFBR1
SCHEMBL18766903 0.81 KMT2A (0.43) MAPTMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL29725623 0.72 ACHE (0.61) MEN1KMT2ASMN1; SMN2DRD2
SCHEMBL3418637 0.72 ALDH1A1 (0.62) MAPTMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL32665269 0.71 CKS1B (0.55) MAPTKMT2ADRD2ACACBCKS1B
SCHEMBL3052457 0.71 HDAC3 (0.59) DRD2CKS1BSKP1SKP2
SCHEMBL29725612 0.70 MAPT (0.63) MAPTSMN1; SMN2DRD2ALDH1A1GAA

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-2017066705-A1 COMPOUNDS, COMPOSITIONS AND METHODS OF USE AGAINST STRESS GRANULES AQUINNAH PHARMACEUTICALS, INC. (US) 2017-04-20 — — WO disclosed
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