SCHEMBL8136241

SCHEMBL8136241

CN1CCN(c2c(F)cc(C(=O)C(F)C(=O)O)cc2F)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
KDM4E B2RXH2 9/20 0.40
MAPT P10636 2/20 0.39
ADRA2B P18089 1/20 0.38
MAPK1 P28482 1/20 0.38
NPC1 O15118 1/20 0.38
LMNA P02545 1/20 0.38
TP53 P04637 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ALDH1A1 P00352 4/20 0.38
HSD17B10 Q99714 4/20 0.38
HPGD P15428 3/20 0.38
ALB P02768 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
TUBB4A P04350 1/20 0.36
POLB P06746 1/20 0.36
TUBB P07437 1/20 0.36
TUBA3C P0DPH7 1/20 0.36

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
SCHEMBL8129697 0.83 MEN1 (0.47) MEN1KMT2AKDM4EMAPTMAPK1
SCHEMBL10782883 0.72 CES2 (0.55) MAPK1LMNARAB9A
SCHEMBL17431865 0.71 MAPT (0.44) MEN1KMT2AKDM4EMAPTADRA2B
SCHEMBL8275459 0.70 MAPT (0.46) MEN1KMT2AKDM4EMAPTADRA2B
SCHEMBL8120918 0.69 KDM4E (0.49) MEN1KMT2AKDM4EMAPTADRA2B
SCHEMBL18879718 0.69 MAPT (0.40) MEN1KMT2AKDM4EMAPTADRA2B
SCHEMBL13757013 0.69 MAPT (0.45) MEN1KMT2AKDM4EMAPTNPC1
SCHEMBL14924079 0.68 MAPT (0.42) KMT2AKDM4EMAPTADRA2BMAPK1
SCHEMBL24681374 0.68 SMN1; SMN2 (0.45) MEN1KMT2AKDM4EMAPTSMN1; SMN2
SCHEMBL28502420 0.68 MAPT (0.51) MEN1KMT2AKDM4EMAPTADRA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0675880-B1 QUINOLINE DISULFIDES AS INTERMEDIATES ARCHIMICA SPA (IT) 2000-01-05 EP claimed
EP-0675880-B1 QUINOLINE DISULFIDES AS INTERMEDIATES ARCHIMICA SPA (IT) 2000-01-05 EP disclosed
US-5731433-A Process for the preparation of rufloxacin and salts thereof ARCHIMICA SPA (IT) 1998-03-24 US disclosed
EP-0725785-B1 PROCESS FOR THE PREPARATION OF RUFLOXACIN AND SALTS THEREOF ARCHIMICA SPA (IT) 1997-07-23 EP disclosed
EP-0725785-A1 PROCESS FOR THE PREPARATION OF RUFLOXACIN AND SALTS THEREOF ARCHIMICA SPA (IT) 1996-08-14 EP disclosed
EP-0675880-A1 QUINILONE DISULFIDE AS INTERMEDIATES ARCHIMICA S.P.A. (IT) 1995-10-11 EP disclosed
WO-1995011907-A1 PROCESS FOR THE PREPARATION OF RUFLOXACIN AND SALTS THEREOF ARCHIMICA S.P.A. (IT) 1995-05-04 WO disclosed
WO-1995011886-A1 QUINILONE DISULFIDE AS INTERMEDIATES ARCHIMICA S.P.A. (IT) 1995-05-04 WO disclosed