SCHEMBL7741023

SCHEMBL7741023

CN(C(=O)COC(CCNC(=O)c1ccc(Cl)cc1)C(=O)NO)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TMEM97 Q5BJF2 4/20 0.45
SIGMAR1 Q99720 4/20 0.45
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.43
DRD4 P21917 1/20 0.42
GAA P10253 1/20 0.41
SNCA P37840 1/20 0.41
SMN1; SMN2 Q16637 4/20 0.40
MAPK1 P28482 1/20 0.40
NTSR1 P30989 1/20 0.40
HTT P42858 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
NOD2 Q9HC29 1/20 0.40
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 1/20 0.40
PYGL P06737 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
LMNA P02545 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL7741193 0.91 TMEM97 (0.47) TMEM97SIGMAR1KMT2AMEN1DRD4
SCHEMBL7741011 0.86 TMEM97 (0.43) TMEM97SIGMAR1KMT2AMEN1GAA
SCHEMBL7742614 0.86 SIGMAR1 (0.53) TMEM97SIGMAR1KMT2AMEN1SMN1; SMN2
SCHEMBL7741018 0.85 TMEM97 (0.54) TMEM97SIGMAR1KMT2AMEN1GAA
SCHEMBL7740225 0.77 SIGMAR1 (0.54) TMEM97SIGMAR1KMT2AMEN1SMN1; SMN2
SCHEMBL7742567 0.77 TMEM97 (0.46) TMEM97SIGMAR1KMT2AMEN1GAA
SCHEMBL7741141 0.77 SIGMAR1 (0.56) TMEM97SIGMAR1KMT2AMEN1SMN1; SMN2
SCHEMBL7739596 0.76 NPC1 (0.47) TMEM97SIGMAR1KMT2AMEN1GAA
SCHEMBL7742570 0.75 TMEM97 (0.57) TMEM97SIGMAR1GAASMN1; SMN2ALDH1A1
SCHEMBL8117410 0.75 TMEM97 (0.46) TMEM97SIGMAR1KMT2AMEN1SNCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6420427-B1 PREVENTION AND/OR TREATMENT OF RHEUMATOID DISEASES, ARTHROSTEITIS, UNUSUAL BONE RESORPTION, OSTEOPOROSIS, PERIODONTITIS, INTERSTITIAL NEPHRITIS, ARTERIOSCLEROSIS, PULMONARY EMPHYSEMA, CIRRHOSIS, CORNEA INJURY ONO PHARMACEUTICAL CO., LTD. (JP) 2002-07-16 US claimed
EP-1024134-A1 AMINOBUTANOIC ACID DERIVATIVES ONO PHARMACEUTICAL CO., LTD. (JP) 2000-08-02 EP claimed
US-6420427-B1 PREVENTION AND/OR TREATMENT OF RHEUMATOID DISEASES, ARTHROSTEITIS, UNUSUAL BONE RESORPTION, OSTEOPOROSIS, PERIODONTITIS, INTERSTITIAL NEPHRITIS, ARTERIOSCLEROSIS, PULMONARY EMPHYSEMA, CIRRHOSIS, CORNEA INJURY ONO PHARMACEUTICAL CO., LTD. (JP) 2002-07-16 US disclosed
EP-1024134-A1 AMINOBUTANOIC ACID DERIVATIVES ONO PHARMACEUTICAL CO., LTD. (JP) 2000-08-02 EP disclosed