SCHEMBL8136234

SCHEMBL8136234

CN1CCN(c2c(F)cc(C(=O)CC(=O)O)c(F)c2F)CC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.52
ADRA2B P18089 1/20 0.39
MAPK1 P28482 1/20 0.39
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ALDH1A1 P00352 5/20 0.39
HPGD P15428 4/20 0.39
HSD17B10 Q99714 3/20 0.39
ALB P02768 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38
MAPT P10636 1/20 0.37
TUBB4A P04350 1/20 0.37
POLB P06746 1/20 0.37
TUBB P07437 1/20 0.37
TUBA3C P0DPH7 1/20 0.37
TUBA1B P68363 1/20 0.37
TUBA4A P68366 1/20 0.37
TUBB4B P68371 1/20 0.37
TUBB3 Q13509 1/20 0.37

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
SCHEMBL3606905 0.84 MEN1 (0.47) KDM4EMAPK1KMT2AMEN1L3MBTL1
SCHEMBL8155555 0.80 KDM4E (0.42) KDM4EADRA2BMAPK1KMT2AMEN1
SCHEMBL8120918 0.78 KDM4E (0.49) KDM4EADRA2BMAPK1KMT2AMEN1
SCHEMBL8154760 0.74 KDM4E (0.46) KDM4EADRA2BMAPK1KMT2AMEN1
SCHEMBL9469723 0.74 KDM4E (0.47) KDM4EADRA2BMAPK1KMT2AMEN1
SCHEMBL9016703 0.73 MAPT (0.41) KDM4EMAPK1KMT2AMEN1L3MBTL1
SCHEMBL9565709 0.73 KDM4E (0.44) KDM4EADRA2BMAPK1KMT2AMEN1
SCHEMBL1187294 0.72 PTPN1 (0.38) MAPK1ALDH1A1SMN1; SMN2
SCHEMBL30194898 0.72 PTPN1 (0.38) MAPK1ALDH1A1SMN1; SMN2
SCHEMBL3611468 0.72 KDM4E (0.42) KDM4EADRA2BMAPK1KMT2AMEN1

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
EP-0675880-B1 QUINOLINE DISULFIDES AS INTERMEDIATES ARCHIMICA SPA (IT) 2000-01-05 EP claimed
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