SCHEMBL8328016

SCHEMBL8328016

C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCN([C@@H](C)c2ccccc2)C1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CTSK P43235 3/20 0.44
CTSS P25774 1/20 0.41
ATM Q13315 1/20 0.41
KMT2A Q03164 2/20 0.40
DRD4 P21917 1/20 0.40
GPR119 Q8TDV5 1/20 0.40
CTSL P07711 1/20 0.40
MAPK1 P28482 1/20 0.39
CYP2D6 P10635 1/20 0.39
CHRM4 P08173 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
SCHEMBL8329651 1.00 CTSK (0.44) CTSKCTSSATMKMT2ADRD4
SCHEMBL8330267 1.00 CTSK (0.44) CTSKCTSSATMKMT2ADRD4
SCHEMBL8330691 1.00 CTSK (0.44) CTSKCTSSATMKMT2ADRD4
SCHEMBL8325994 1.00 CTSK (0.44) CTSKCTSSATMKMT2ADRD4
SCHEMBL8326719 1.00 CTSK (0.44) CTSKCTSSATMKMT2ADRD4
SCHEMBL8331106 1.00 CTSK (0.44) CTSKCTSSATMKMT2ADRD4
SCHEMBL8332588 1.00 CTSK (0.44) CTSKCTSSATMKMT2ADRD4
SCHEMBL8468596 1.00 CTSK (0.44) CTSKCTSSATMKMT2ADRD4
SCHEMBL4715472 0.90 CTSK (0.43) CTSKCTSSKMT2ADRD4GPR119
SCHEMBL4714909 0.90 CTSK (0.43) CTSKCTSSKMT2ADRD4GPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0559774-B1 INDIVIDUAL STEREOISOMERS OF 7- 3-(1-AMINOALKYL)-1-PYRROLIDINYL]-QUINOLONES AND NAPHTHYRIDONES AS ANTIBACTERIAL AGENTS WARNER LAMBERT CO (US) 1999-07-07 EP disclosed
EP-0909759-A2 Individual stereoisomers of 7-(3-aminoalkyl)-1-pyrrolidinyl)-quinolones as antibacterial agents WARNER-LAMBERT COMPANY (US) 1999-04-21 EP disclosed
US-5633264-A Individual stereoisomers of 7-[3-(1-aminoalkyl)-1-pyrrolidinyl]-Quinolones and naphthyridones as antibacterial agents WARNER-LAMBERT COMPANY (US) 1997-05-27 US disclosed
US-5563155-A QUINOLONE ANTIBIOTICS WITH INCREASED EFFICACY, REDUCED SIDE EFFECTS WARNER-LAMBERT COMPANY (US) 1996-10-08 US disclosed
US-5461165-A Individual stereoisomers of intermediates of 7-[3-(1-aminoalkyl)-1-pyrrolidinyl]-quinolones and naphthyridones as antibacterial agents WARNER-LAMBERT COMPANY (US) 1995-10-24 US disclosed
US-5344940-A Bactericides WARNER-LAMBERT COMPANY (US) 1994-09-06 US disclosed
US-5258528-A Bactericides WARNER-LAMBERT COMPANY (US) 1993-11-02 US disclosed
EP-0559774-A1 INDIVIDUAL STEREOISOMERS OF 7- 3-(1-AMINOALKYL)-1-PYRROLIDINYL]-QUINOLONES AND NAPHTHYRIDONES AS ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY (US) 1993-09-15 EP disclosed
WO-1992009596-A1 INDIVIDUAL STEREOISOMERS OF 7-[3-(1-AMINOALKYL)-1-PYRROLIDINYL]-QUINOLONES AND NAPHTHYRIDONES AS ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY (US) 1992-06-11 WO disclosed