SCHEMBL11221157

SCHEMBL11221157

COC(=O)n1ccc2c(Cl)cccc21

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ NOTUM Q6P988 2/20 0.69
▸ KMT2A Q03164 3/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ NR3C2 P08235 8/20 0.46
▸ ALDH1A1 P00352 2/20 0.45
▸ MAPT P10636 1/20 0.45
▸ POLB P06746 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ PGR P06401 3/20 0.37
▸ NR4A2 P43354 1/20 0.37
▸ KRAS P01116 1/20 0.37

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
SCHEMBL2115310 0.84 NOTUM (0.65) NOTUMNR3C2ALDH1A1MAPTKDM4E
SCHEMBL30763696 0.83 NOTUM (0.63) NOTUMKMT2AMEN1NR3C2ALDH1A1
SCHEMBL2878376 0.83 NOTUM (0.63) NOTUMKMT2AMEN1NR3C2ALDH1A1
SCHEMBL6886131 0.82 KMT2A (0.49) NOTUMKMT2AMEN1ALDH1A1MAPT
SCHEMBL11216414 0.81 KMT2A (0.48) NOTUMKMT2AMEN1NR3C2ALDH1A1
SCHEMBL15018177 0.80 NOTUM (0.72) NOTUMKMT2ANR3C2ALDH1A1MAPT
SCHEMBL27774897 0.79 KMT2A (0.65) NOTUMKMT2AMEN1ALDH1A1MAPT
SCHEMBL28841086 0.77 NOTUM (0.69) NOTUMKMT2ANR3C2ALDH1A1MAPT
SCHEMBL13500647 0.76 ALDH1A1 (0.41) NOTUMKMT2AMEN1ALDH1A1MAPT
SCHEMBL18054200 0.75 NOTUM (0.49) NOTUMKMT2AMEN1ALDH1A1POLB

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-57159765-A — — None — — JP disclosed
JP-S57159765-A 4-SUBSTITUTED-1-METHOXYCARBONYLINDOLE COMPOUND NISSAN CHEM IND LTD 1982-10-01 — — JP disclosed
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