SCHEMBL7323248

SCHEMBL7323248

Cc1cccc(C2(OC[C@H](N)C(=O)O)c3ccccc3Sc3ccccc32)c1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 12/20 0.40
SLC1A5 Q15758 2/20 0.37
BCHE P06276 2/20 0.35
MEN1 O00255 1/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
ALOX12 P18054 1/20 0.34
KMT2A Q03164 1/20 0.34
EDNRB P24530 1/20 0.33
EDNRA P25101 1/20 0.33
LMNA P02545 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL7326141 0.88 KIF11 (0.42) KIF11SLC1A5MEN1KMT2A
SCHEMBL7326447 0.87 KIF11 (0.47) KIF11SLC1A5EDNRBEDNRALMNA
SCHEMBL7323108 0.87 KIF11 (0.47) KIF11SLC1A5MEN1KMT2A
SCHEMBL7314762 0.85 KIF11 (0.51) KIF11SLC1A5
SCHEMBL7320451 0.84 KIF11 (0.40) KIF11SLC1A5EDNRBEDNRALMNA
SCHEMBL7322275 0.84 KIF11 (0.40) KIF11SLC1A5EDNRBEDNRALMNA
SCHEMBL7315875 0.78 KIF11 (0.58) KIF11
SCHEMBL7315871 0.78 KIF11 (0.58) KIF11
SCHEMBL7311886 0.74 KIF11 (0.43) KIF11SLC1A5MEN1KMT2A
SCHEMBL7314907 0.74 KIF11 (0.55) KIF11SLC1A5MEN1KMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1999041227-A1 TRICYCLIC COMPOUNDS AS GLYCINE TRANSPORT INHIBITORS ALLELIX NEUROSCIENCE, INC. (US) 1999-08-19 WO claimed
US-6162824-A NERVOUS SYSTEM DISORDERS; PSYCHOLOGICAL DISORDERS ALLELIX NEUROSCIENCE INC. 2000-12-19 US disclosed
WO-1999041227-A1 TRICYCLIC COMPOUNDS AS GLYCINE TRANSPORT INHIBITORS ALLELIX NEUROSCIENCE, INC. (US) 1999-08-19 WO disclosed