SCHEMBL27555301

SCHEMBL27555301

CCC(=O)Oc1ccc2c(C(C)=O)cn(Cc3ccccc3)c2c1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.53
▸ POLB P06746 1/20 0.51
▸ LMNA P02545 3/20 0.49
▸ ALDH1A1 P00352 2/20 0.49
▸ SERPINE1 P05121 2/20 0.49
▸ CNR1 P21554 2/20 0.48
▸ CNR2 P34972 2/20 0.48
▸ CHRM1 P11229 1/20 0.47
▸ MAPK1 P28482 2/20 0.46
▸ NPSR1 Q6W5P4 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ TP53 P04637 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ ADORA1 P30542 1/20 0.44
▸ HDAC1 Q13547 1/20 0.44
▸ HDAC2 Q92769 1/20 0.44
▸ HDAC6 Q9UBN7 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
SCHEMBL9056108 0.90 LMNA (0.55) L3MBTL1POLBLMNAALDH1A1SERPINE1
SCHEMBL27486760 0.89 LMNA (0.61) L3MBTL1POLBLMNAALDH1A1TP53
SCHEMBL8802855 0.81 LMNA (0.64) LMNAALDH1A1SERPINE1MAPK1TP53
SCHEMBL6768371 0.80 POLB (0.49) L3MBTL1POLBLMNAALDH1A1SERPINE1
SCHEMBL27555299 0.78 POLB (0.55) L3MBTL1POLBLMNAALDH1A1SERPINE1
SCHEMBL30049353 0.77 POLB (0.79) L3MBTL1POLBLMNAALDH1A1CNR1
SCHEMBL17324721 0.77 POLB (0.79) L3MBTL1POLBLMNAALDH1A1CNR1
SCHEMBL8388127 0.77 POLB (0.60) L3MBTL1POLBALDH1A1SERPINE1CNR1
SCHEMBL9058088 0.76 HDAC8 (0.49) LMNAHTTHDAC1HDAC2HDAC6
SCHEMBL16259052 0.74 POLB (0.53) L3MBTL1POLBLMNAALDH1A1SERPINE1

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-1166169-A Heterocyclic compounds, useful as allosteric effectors at muscarinic receptors SANKYO CO (JP) 1997-11-26 — — CN disclosed
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