SCHEMBL14489581

SCHEMBL14489581

O=S(=O)(Cc1ccc(Cl)cc1)N1CCCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.73
TSHR P16473 2/20 0.66
HPGD P15428 1/20 0.66
ALDH1A1 P00352 3/20 0.56
MAPT P10636 2/20 0.55
RECQL P46063 1/20 0.55
KDM4E B2RXH2 2/20 0.54
PKM P14618 1/20 0.53
NPC1 O15118 1/20 0.48
ALKBH5 Q6P6C2 1/20 0.47
LMNA P02545 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL3894981 0.84 L3MBTL1 (0.67) L3MBTL1TSHRHPGDMAPTRECQL
SCHEMBL14489595 0.82 L3MBTL1 (0.51) L3MBTL1TSHRHPGDALDH1A1MAPT
SCHEMBL2933466 0.81 HPGD (0.66) L3MBTL1TSHRHPGDALDH1A1MAPT
SCHEMBL1425543 0.81 HPGD (0.66) L3MBTL1TSHRHPGDALDH1A1MAPT
SCHEMBL6738518 0.81 TSHR (0.96) TSHRHPGDALDH1A1MAPTKDM4E
SCHEMBL13081206 0.81 HPGD (0.60) L3MBTL1TSHRHPGDALDH1A1MAPT
SCHEMBL23747579 0.80 CHRM1 (0.63) NPC1
SCHEMBL7401505 0.80 HPGD (0.69) L3MBTL1TSHRHPGDALDH1A1MAPT
SCHEMBL9612077 0.79 TSHR (1.00) TSHRHPGDALDH1A1MAPTKDM4E
SCHEMBL3936704 0.79 TSHR (1.00) TSHRHPGDALDH1A1MAPTKDM4E

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