SCHEMBL7526406

SCHEMBL7526406

Cc1ccccc1S(=O)(=O)N[C@@H](c1ccccc1)[C@@H](N)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 2/20 0.56
SLC1A2 P43004 2/20 0.56
SLC1A1 P43005 2/20 0.56
ITGAV P06756 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
ATM Q13315 1/20 0.44
ITGA2 P17301 1/20 0.41
CASP1 P29466 3/20 0.39
ALDH1A1 P00352 3/20 0.39
POLB P06746 2/20 0.39
KMT2A Q03164 2/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39
TP53 P04637 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
DPP4 P27487 2/20 0.38
ALKBH2 Q6NS38 1/20 0.38
ALKBH3 Q96Q83 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38

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
SCHEMBL7646219 1.00 SLC1A3 (0.56) SLC1A3SLC1A2SLC1A1ITGAVL3MBTL1
SCHEMBL3232763 1.00 SLC1A3 (0.56) SLC1A3SLC1A2SLC1A1ITGAVL3MBTL1
SCHEMBL7613315 0.98 SLC1A3 (0.55) SLC1A3SLC1A2SLC1A1ITGAVL3MBTL1
P-Cymene SCHEMBL7517557 0.89 SLC1A3 (0.46) SLC1A3SLC1A2SLC1A1ITGAVL3MBTL1
P-Cymene SCHEMBL7514746 0.89 SLC1A3 (0.46) SLC1A3SLC1A2SLC1A1ITGAVL3MBTL1
SCHEMBL3625563 0.88 SLC1A3 (0.47) SLC1A3SLC1A2SLC1A1ITGAVL3MBTL1
SCHEMBL14920082 0.85 SLC1A3 (0.42) SLC1A3SLC1A2SLC1A1ITGAVL3MBTL1
SCHEMBL3630665 0.84 SLC1A3 (0.43) SLC1A3SLC1A2SLC1A1L3MBTL1ATM
SCHEMBL3630043 0.84 SLC1A3 (0.43) SLC1A3SLC1A2SLC1A1L3MBTL1ATM
SCHEMBL3633522 0.84 SLC1A3 (0.43) SLC1A3SLC1A2SLC1A1L3MBTL1ATM

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
EP-1174426-A1 METHOD FOR THE PREPARATION OF TRICYCLIC AMINO ALCOHOL DERIVATIVES THROUGH AZIDES Asahi Kasei Kabushiki Kaisha (JP) 2002-01-23 EP disclosed