SCHEMBL4740976

SCHEMBL4740976

Cc1ccc(S(=O)(=O)n2nc(N3CCN(C(=O)O)CC3)c3ccccc32)cc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 9/20 0.49
RAB9A P51151 1/20 0.46
ALOX5 P09917 1/20 0.43
HTR6 P50406 1/20 0.43
GAA P10253 4/20 0.43
PKM P14618 1/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
KMT2A Q03164 1/20 0.43
LMNA P02545 1/20 0.43
SMO Q99835 1/20 0.43
SLC9A1 P19634 1/20 0.43
AGTR1 P30556 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL3338109 0.86 MEN1 (0.48) GBA1RAB9AHTR6MEN1KMT2A
Hydrochloric Acid SCHEMBL26911935 0.82 HTR6 (0.52) GBA1RAB9AHTR6ALDH1A1SLC9A1
Hydrochloric Acid SCHEMBL30611197 0.82 HTR6 (0.52) GBA1RAB9AHTR6ALDH1A1SLC9A1
SCHEMBL1544929 0.80 HTR6 (0.56) HTR6
SCHEMBL1545834 0.79 ALOX15 (0.46) HTR6GAAALDH1A1KMT2ASMO
SCHEMBL8789689 0.75 HTR6 (0.63) HTR6
SCHEMBL1545076 0.74 HTR6 (0.43) GBA1HTR6GAAPKMALDH1A1
SCHEMBL12253486 0.74 SLC9A1 (0.56) HTR6GAAMEN1ALDH1A1KMT2A
SCHEMBL12253466 0.72 NR1H2 (0.56) HTR6GAAMEN1ALDH1A1KMT2A
SCHEMBL9400073 0.72 ELANE (0.52) GBA1ALOX5GAAMEN1ALDH1A1

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
EP-1984351-A1 COMPOUNDS HAVING 5-HT6 RECEPTOR AFFINITY Memory Pharmaceuticals Corporation (US) 2008-10-29 EP disclosed
WO-2007098418-A1 COMPOUNDS HAVING 5-HT6 RECEPTOR AFFINITY MEMORY PHARMACEUTICALS CORPORATION (US) 2007-08-30 WO disclosed