SCHEMBL9011954

SCHEMBL9011954

CN(C)C(c1ccccc1)[S+]([O-])c1nccn1-c1ccccc1F

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
PTGS1 P23219 1/20 0.30
PTGS2 P35354 1/20 0.30

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
SCHEMBL9012047 0.81 KDM4E (0.34) KDM4E
SCHEMBL9234932 0.78 OPRL1 (0.33) MEN1KMT2A
SCHEMBL9011926 0.74 KDR (0.32)
SCHEMBL9802855 0.71 KDM4E (0.33) KDM4E
SCHEMBL15315975 0.63 KDR (0.44) KDM4E
SCHEMBL9823835 0.59 ALDH1A1 (0.44) KDM4E
SCHEMBL28817942 0.59 KDM4E (0.43) KDM4EMEN1KMT2APTGS1PTGS2
SCHEMBL8698387 0.57 MAPT (0.35) MEN1KMT2A
SCHEMBL9016862 0.57 MAPT (0.35) MEN1KMT2A
SCHEMBL28817884 0.56 KDM4E (0.40) KDM4EMEN1KMT2APTGS1PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5523317-A ADMINISTERING IMIDAZOLE DERIVATIVE NIPPON CHEMIPHAR CO., LTD. (JP) 1996-06-04 US disclosed
EP-0633026-A1 Use of imidazole derivative for antihypertensive agent NIPPON CHEMIPHAR CO., LTD. (JP) 1995-01-11 EP disclosed