SCHEMBL9191920

SCHEMBL9191920

O=C1CC2CC[S+]([O-])c3ccc(F)cc3C2=NN1c1ccc(Cl)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 4/20 0.36
LMNA P02545 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
AMY1A P0DUB6 1/20 0.35
PTBP1 P26599 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
GAA P10253 1/20 0.32
KCNH2 Q12809 1/20 0.32
DRD2 P14416 3/20 0.32
DRD3 P35462 3/20 0.32
DRD1 P21728 2/20 0.32
GABRP O00591 1/20 0.32
GABRD O14764 1/20 0.32

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
SCHEMBL7297596 0.92 MAPT (0.38) GRM5LMNAMEN1KMT2AALDH1A1
SCHEMBL10561445 0.90 GRM5 (0.37) GRM5LMNAMEN1KMT2AALDH1A1
SCHEMBL7288991 0.86 GABRP (0.40) LMNAMEN1KMT2AALDH1A1MAPT
SCHEMBL10560746 0.84 GRM5 (0.35) GRM5LMNAMEN1KMT2AALDH1A1
SCHEMBL10365659 0.81 GRM5 (0.38) GRM5LMNAMEN1KMT2AALDH1A1
SCHEMBL10560151 0.81 MAPT (0.39) GRM5LMNAMEN1KMT2AALDH1A1
SCHEMBL7289927 0.78 ALDH1A1 (0.36) LMNAMEN1KMT2AALDH1A1MAPT
SCHEMBL7288749 0.78 GRM5 (0.36) GRM5LMNAMEN1KMT2AALDH1A1
SCHEMBL10558366 0.78 MAPT (0.42) GRM5LMNAMEN1KMT2AALDH1A1
SCHEMBL7298595 0.77 PDE4A (0.38) LMNAMEN1KMT2AALDH1A1MAPT

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
EP-0487768-B1 Pharmaceutical composition with improved dissolution property YOSHITOMI PHARMACEUTICAL (JP) 1995-01-25 EP claimed
EP-0487768-A1 Pharmaceutical composition with improved dissolution property YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1992-06-03 EP claimed
EP-0487768-B1 Pharmaceutical composition with improved dissolution property YOSHITOMI PHARMACEUTICAL (JP) 1995-01-25 EP disclosed
EP-0487768-A1 Pharmaceutical composition with improved dissolution property YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1992-06-03 EP disclosed