SCHEMBL1808705

SCHEMBL1808705

O=c1[nH]n(Cc2ccc(F)cc2)c2ccc(NS(=O)(=O)c3ccc4c(c3)OCCO4)cc12

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PKM P14618 4/20 0.51
KMT2A Q03164 4/20 0.49
MEN1 O00255 3/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
TAS2R14 Q9NYV8 2/20 0.49
HPGD P15428 2/20 0.49
TSHR P16473 1/20 0.49
MAPT P10636 6/20 0.47
HTT P42858 3/20 0.47
LMNA P02545 3/20 0.47
USP2 O75604 1/20 0.45
TP53 P04637 1/20 0.45
ALDH1A1 P00352 3/20 0.45
RECQL P46063 1/20 0.45
GAA P10253 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
SCHEMBL4353879 0.91 HPGD (0.51) PKMKMT2AMEN1SMN1; SMN2TAS2R14
SCHEMBL1811639 0.83 PTGDR2 (0.48) PKMKMT2AMEN1SMN1; SMN2TSHR
SCHEMBL3904637 0.81 BRD4 (0.50) PKMKMT2AMEN1SMN1; SMN2HPGD
SCHEMBL1843321 0.81 FFAR4 (0.43) PKMSMN1; SMN2MAPTLMNATP53
SCHEMBL1819937 0.78 BRD4 (0.52) MAPTALDH1A1
SCHEMBL3913785 0.77 PTGDR2 (0.48) PKMKMT2AMEN1SMN1; SMN2TSHR
SCHEMBL3909056 0.77 BRD4 (0.40) PKMSMN1; SMN2TSHRTP53ALDH1A1
SCHEMBL3904603 0.77 MAPT (0.46) PKMKMT2AMEN1SMN1; SMN2MAPT
SCHEMBL3915102 0.76 PTGDR2 (0.48) PKMKMT2AMEN1TSHRMAPT
SCHEMBL3910618 0.76 SGK1 (0.41) PKMSMN1; SMN2TP53ALDH1A1

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-4682207-B2 2011-05-11 JP claimed
EP-1797042-B1 INDOZOLONE DERIVATIVES AS 11B-HSD1 INHIBITORS HOFFMANN LA ROCHE (CH) 2009-01-07 EP claimed