SCHEMBL6500345

SCHEMBL6500345

CCOc1cc2c(cc1S(=O)(=O)c1ccc(N3CCN(c4ccc(F)cc4)CC3)cc1)CCN(C)CC2

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.51
LMNA P02545 3/20 0.51
NPSR1 Q6W5P4 2/20 0.46
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
HPGD P15428 1/20 0.46
HSD17B10 Q99714 1/20 0.46
HTR6 P50406 1/20 0.44
PKM P14618 1/20 0.43
MAOB P27338 1/20 0.43
TP53 P04637 2/20 0.42
HSD11B1 P28845 1/20 0.41
KMT2A Q03164 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
GAA P10253 1/20 0.40
PDE5A O76074 1/20 0.40
POLB P06746 1/20 0.40

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
SCHEMBL3894249 0.93 POLB (0.43) MAPTLMNANPSR1KDM4EALDH1A1
SCHEMBL6509242 0.88 MAOB (0.54) MAPTLMNAKDM4EHTR6PKM
Hydrochloric Acid SCHEMBL6504357 0.87 MAOB (0.53) MAPTLMNAKDM4EHTR6PKM
SCHEMBL6502662 0.85 HTR6 (0.45) MAPTLMNAHTR6PKMMAOB
SCHEMBL3903162 0.81 MAOB (0.48) KDM4EHTR6PKMMAOBKMT2A
SCHEMBL6505821 0.79 HTR6 (0.47) MAPTLMNAALDH1A1HPGDHTR6
SCHEMBL6510748 0.78 HTR6 (0.46) ALDH1A1HPGDHSD17B10HTR6PKM
SCHEMBL6502583 0.78 LMNA (0.48) MAPTLMNANPSR1ALDH1A1HPGD
SCHEMBL6500880 0.78 LMNA (0.51) MAPTLMNAALDH1A1HTR6PKM
SCHEMBL3893442 0.78 HTR6 (0.49) HTR6MAOBKMT2A

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
WO-2005014578-A1 PHENYLSULFONYL COMPOUNDS AS ANTIPSYCHOTIC AGENTS GLAXO GROUP LIMITED (GB) 2005-02-17 WO claimed
WO-2005014578-A1 PHENYLSULFONYL COMPOUNDS AS ANTIPSYCHOTIC AGENTS GLAXO GROUP LIMITED (GB) 2005-02-17 WO disclosed