SCHEMBL6511504

SCHEMBL6511504

COc1ccccc1N1CCN(c2ccc(S(=O)(=O)c3cc4c(cc3OC)CCN(C)CC4)cc2)CC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.52
DRD3 P35462 1/20 0.52
USP2 O75604 1/20 0.49
LMNA P02545 1/20 0.49
GLA P06280 1/20 0.49
TSHR P16473 1/20 0.49
MAPK1 P28482 1/20 0.49
HSD17B10 Q99714 1/20 0.49
ALDH1A1 P00352 2/20 0.47
TP53 P04637 1/20 0.47
POLB P06746 1/20 0.47
GAA P10253 2/20 0.47
GFER P55789 2/20 0.47
MMP2 P08253 1/20 0.46
MMP13 P45452 1/20 0.46
KMT2A Q03164 4/20 0.46
SMN1; SMN2 Q16637 3/20 0.44
MEN1 O00255 2/20 0.44
MAPT P10636 2/20 0.44
L3MBTL1 Q9Y468 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
SCHEMBL6506073 0.92 LMNA (0.44) DRD2DRD3USP2LMNAGLA
SCHEMBL6500166 0.92 HTR1A (0.43) DRD2DRD3USP2LMNAGLA
SCHEMBL6502583 0.91 LMNA (0.48) DRD2DRD3LMNATSHRALDH1A1
SCHEMBL6500224 0.91 ALDH1A1 (0.50) DRD2DRD3USP2LMNATSHR
SCHEMBL6509242 0.88 MAOB (0.54) LMNATSHRKMT2AMEN1MAPT
SCHEMBL6501982 0.87 DRD2 (0.47) DRD2DRD3USP2LMNAGLA
Hydrochloric Acid SCHEMBL6504357 0.87 MAOB (0.53) LMNATSHRKMT2AMEN1MAPT
SCHEMBL6500880 0.87 LMNA (0.51) DRD2DRD3LMNATSHRMAPK1
SCHEMBL6510748 0.87 HTR6 (0.46) DRD2DRD3MAPK1HSD17B10ALDH1A1
SCHEMBL6504564 0.86 HTR6 (0.54) DRD2DRD3LMNATSHRGAA

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