SCHEMBL9836846

SCHEMBL9836846

CCCCC(=O)Nc1nc(CCl)cs1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 2/20 0.64
SMN1; SMN2 Q16637 5/20 0.64
KMT2A Q03164 3/20 0.64
GAA P10253 2/20 0.55
POLB P06746 1/20 0.54
MAPT P10636 4/20 0.52
HTT P42858 2/20 0.52
CYP1A2 P05177 1/20 0.50
CYP2C19 P33261 1/20 0.50
ALDH1A1 P00352 2/20 0.48
RAB9A P51151 2/20 0.48
NPC1 O15118 1/20 0.48
MAPK10 P53779 1/20 0.48
PDE1A P54750 1/20 0.46
PDE1B Q01064 1/20 0.46
PDE1C Q14123 1/20 0.46
TSHR P16473 1/20 0.46
MAPK1 P28482 1/20 0.46
MEN1 O00255 2/20 0.46
KDM4E B2RXH2 1/20 0.46

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
SCHEMBL4685246 0.96 PDE5A (0.70) PDE5ASMN1; SMN2KMT2AGAAPOLB
SCHEMBL9835391 0.91 SMN1; SMN2 (0.68) PDE5ASMN1; SMN2KMT2AGAAPOLB
SCHEMBL20935220 0.87 PDE5A (0.66) PDE5ASMN1; SMN2KMT2AGAAPOLB
SCHEMBL9677782 0.85 SMN1; SMN2 (0.71) PDE5ASMN1; SMN2KMT2AGAAPOLB
SCHEMBL91408 0.84 PDE5A (0.74) PDE5ASMN1; SMN2KMT2AGAAPOLB
SCHEMBL93110 0.83 PDE5A (0.76) PDE5ASMN1; SMN2KMT2AGAAPOLB
SCHEMBL10084854 0.83 PDE5A (0.57) PDE5ASMN1; SMN2KMT2AGAAPOLB
SCHEMBL9835472 0.82 KMT2A (0.62) PDE5ASMN1; SMN2KMT2AGAAPOLB
SCHEMBL8478547 0.82 SMN1; SMN2 (0.62) PDE5ASMN1; SMN2KMT2AGAAPOLB
SCHEMBL4099160 0.81 PDE5A (0.58) PDE5ASMN1; SMN2GAAPOLBMAPT

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-0224919-B1 NEW THIAZOLE COMPOUNDS, PROCESSES FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-08-14 EP disclosed
US-4742057-A Antiallergic thiazole compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-05-03 US disclosed
EP-0224919-A2 New thiazole compounds, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-06-10 EP disclosed