SCHEMBL28855121

SCHEMBL28855121

N#Cc1ccccc1OC(N)=S.NC(O)=S

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
POLB P06746 1/20 0.41
MAPK1 P28482 1/20 0.37
ALDH1A1 P00352 3/20 0.36
TSHR P16473 2/20 0.36
HPGD P15428 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
TP53 P04637 1/20 0.36
MAPK14 Q16539 1/20 0.36
KCNH2 Q12809 1/20 0.36
LMNA P02545 1/20 0.36
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
HTR1A P08908 1/20 0.35
ADRA2A P08913 1/20 0.35
ADRA2B P18089 1/20 0.35
MAOA P21397 1/20 0.35
HTR2B P41595 1/20 0.35

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
SCHEMBL27347036 0.96 SMN1; SMN2 (0.46) GAASMN1; SMN2POLBMAPK1ALDH1A1
SCHEMBL11824600 0.78 SMN1; SMN2 (0.54) GAASMN1; SMN2POLBMAPK1ALDH1A1
SCHEMBL10630897 0.78 GAA (0.43) GAASMN1; SMN2POLBMAPK1ALDH1A1
SCHEMBL1697190 0.76 SMN1; SMN2 (0.47) GAASMN1; SMN2POLBMAPK1ALDH1A1
SCHEMBL9493355 0.74 GAA (0.44) GAASMN1; SMN2POLBMAPK1ALDH1A1
SCHEMBL124189 0.73 SMN1; SMN2 (0.49) GAASMN1; SMN2POLBMAPK1ALDH1A1
SCHEMBL28806667 0.72 PPARG (0.45) GAASMN1; SMN2POLBALDH1A1TSHR
SCHEMBL21807619 0.72 LMNA (0.41) SMN1; SMN2ALDH1A1TSHRHPGDMEN1
SCHEMBL27689216 0.72 ALDH1A1 (0.49) GAASMN1; SMN2POLBMAPK1ALDH1A1
SCHEMBL6962495 0.72 SMN1; SMN2 (0.47) GAASMN1; SMN2POLBMAPK1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110959019-B Block copolymer and method for producing block copolymer 电化株式会社 2022-10-14 CN disclosed