SCHEMBL8801729

SCHEMBL8801729

NNc1cccc2c1ccc[n+]2[O-]

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.32
HSP90AA1 P07900 1/20 0.32
HTT P42858 1/20 0.32
MITF O75030 1/20 0.31

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
SCHEMBL10647924 0.87 MAPT (0.38) MAPTMITF
SCHEMBL2833315 0.76 RAB9A (0.38) MAPT
SCHEMBL1261956 0.75 ALDH1A1 (0.48) MAPTHSP90AA1HTT
SCHEMBL1295362 0.72 MAPT (0.35) MAPTHSP90AA1HTTMITF
SCHEMBL12751165 0.71 MAPT (0.34) MAPTHSP90AA1HTTMITF
SCHEMBL2798258 0.71 CYP1A2 (0.48) MAPTHSP90AA1HTT
SCHEMBL1747611 0.71 MAPT (0.46) MAPTHSP90AA1HTTMITF
SCHEMBL30873742 0.71 MAPT (0.46) MAPTHSP90AA1HTTMITF
SCHEMBL4437293 0.71 MAPT (0.42) MAPTHSP90AA1HTTMITF
SCHEMBL5800459 0.71 CYP1A2 (0.48) MAPTHSP90AA1HTT

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-5646163-A FOR TREATING OR PREVENTING BACTERIAL INFECTIONS IN HUMANS OR ANIMALS THE PROCTER & GAMBLE COMPANY (US) 1997-07-08 US disclosed
EP-0757675-A1 NOVEL QUINOLONE 5-(N-HETEROSUBSTITUTED AMINO) ANTIMICROBIALS THE PROCTER & GAMBLE COMPANY (US) 1997-02-12 EP disclosed
WO-1995029894-A1 NOVEL QUINOLONE 5-(N-HETEROSUBSTITUTED AMINO) ANTIMICROBIALS THE PROCTER & GAMBLE COMPANY (US) 1995-11-09 WO disclosed
WO-1994010163-A1 ANTIMICROBIAL 5-HYDRAZINO-QUINOLONE DERIVATIVES THE PROCTER & GAMBLE COMPANY (US) 1994-05-11 WO disclosed