SCHEMBL14489595

SCHEMBL14489595

O=S(=O)(CCc1ccc(Cl)cc1)N1CCCC1

nearest known ligand 0.70

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.51
LMNA P02545 1/20 0.51
ALDH1A1 P00352 5/20 0.48
GAA P10253 1/20 0.47
TSHR P16473 2/20 0.47
MAPT P10636 2/20 0.47
HTT P42858 1/20 0.47
KDM4E B2RXH2 2/20 0.46
HPGD P15428 1/20 0.45
LSS P48449 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
SCHEMBL30137244 0.83 HRH3 (0.51) L3MBTL1LMNAALDH1A1TSHRHTT
SCHEMBL14489581 0.82 L3MBTL1 (0.73) L3MBTL1LMNAALDH1A1TSHRMAPT
SCHEMBL30137230 0.81 HRH3 (0.50) L3MBTL1LMNAALDH1A1TSHRHPGD
SCHEMBL2846266 0.74 L3MBTL1 (0.38) L3MBTL1LMNAALDH1A1GAAMAPT
SCHEMBL198598 0.73 TAAR1 (0.50) ALDH1A1HTT
SCHEMBL105528 0.71 TAAR1 (0.48) ALDH1A1
SCHEMBL27804764 0.71 TAAR1 (0.48) ALDH1A1
SCHEMBL10602252 0.70 L3MBTL1 (0.52) L3MBTL1LMNAALDH1A1LSS
SCHEMBL8113789 0.70 RECQL (0.64)
SCHEMBL3135932 0.70 TAAR1 (0.46) HTT

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-2007065093-A2 PYRROLIDINEANILINES SMITHKLINE BEECHAM CORPORATION (US) 2007-06-07 WO disclosed