SCHEMBL7651810

SCHEMBL7651810

Cc1nccc(N2CCC(CN3CCN(S(=O)(=O)c4ccc(Br)cc4)CC3O)CC2)n1

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LSS P48449 3/20 0.63
F10 P00742 3/20 0.38
GBA1 P04062 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.35
MAPK1 P28482 1/20 0.35
GPBAR1 Q8TDU6 1/20 0.35
ALDH1A1 P00352 1/20 0.35
APAF1 O14727 1/20 0.35
GAA P10253 1/20 0.35
HPGD P15428 1/20 0.35
NOD2 Q9HC29 1/20 0.35

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
SCHEMBL7655662 0.89 LSS (0.49) LSSF10GBA1KMT2AMEN1
SCHEMBL7651807 0.81 LSS (0.61) LSSF10GBA1SMN1; SMN2KMT2A
SCHEMBL6182258 0.77 LSS (1.00) LSSF10LMNAMAPK1ALDH1A1
SCHEMBL8309729 0.76 LSS (0.89) LSSF10LMNAMAPK1ALDH1A1
SCHEMBL6977387 0.76 LSS (0.76) LSSGBA1SMN1; SMN2KMT2AMEN1
SCHEMBL6977994 0.74 LSS (0.93) LSSALDH1A1HPGD
SCHEMBL6977537 0.74 LSS (0.93) LSSSMN1; SMN2KDM4ELMNAMAPK1
SCHEMBL8310078 0.73 LSS (0.83) LSSSMN1; SMN2LMNAMAPK1ALDH1A1
SCHEMBL7682080 0.73 LSS (0.54) LSSGBA1KMT2AMEN1KDM4E
SCHEMBL6978604 0.72 LSS (0.71) LSSGBA1SMN1; SMN2KMT2AMEN1

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
US-6335341-B1 ANTICHOLESTEROL AGENTS; ATHEROSCLEROSIS ZENECA LIMITED (GB) 2002-01-01 US disclosed