SCHEMBL6011856

SCHEMBL6011856

Cc1ccc(N(CC(=O)Nc2ccc(-c3cocn3)cc2)C(=O)C2CCSCC2)cc1C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.36
▸ USP2 O75604 2/20 0.35
▸ GAA P10253 2/20 0.35
▸ MEN1 O00255 4/20 0.34
▸ CHRM1 P11229 2/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ NPC1 O15118 2/20 0.33
▸ RAB9A P51151 2/20 0.33
▸ TP53 P04637 1/20 0.33
▸ DRD4 P21917 1/20 0.33
▸ LMNA P02545 2/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ HTT P42858 2/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL6011888 0.93 LMNA (0.34) KMT2AMEN1CHRM1RAB9ALMNA
SCHEMBL17923456 0.91 KMT2A (0.37) KMT2AGAAMEN1SMN1; SMN2NPC1
SCHEMBL2240153 0.89 ALDH1A1 (0.39) KMT2AUSP2GAAMEN1CHRM1
SCHEMBL2239299 0.83 HDAC1 (0.36) CHRM1SMN1; SMN2LMNAL3MBTL1POLB
SCHEMBL2236865 0.82 HDAC1 (0.37) CHRM1RAB9ALMNAL3MBTL1ALDH1A1
SCHEMBL14000172 0.81 GAA (0.37) KMT2AGAAMEN1CHRM1SMN1; SMN2
SCHEMBL14000182 0.81 KMT2A (0.37) KMT2AGAAMEN1CHRM1SMN1; SMN2
SCHEMBL14000185 0.80 TSHR (0.39) KMT2AGAAMEN1SMN1; SMN2NPC1
SCHEMBL14000181 0.80 CNR1 (0.37) KMT2AGAAMEN1NPC1RAB9A
SCHEMBL14000186 0.79 GAA (0.36) KMT2AGAAMEN1NPC1RAB9A

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
EP-1652843-A1 AMIDE DERIVATIVES Astellas Pharma Inc. (JP) 2006-05-03 — — EP disclosed
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