SCHEMBL10497609

SCHEMBL10497609

CCOc1ccc2c(c1)SC(=Cc1ccc(C)cc1)C2=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.55
MEN1 O00255 6/20 0.55
KMT2A Q03164 6/20 0.55
SMN1; SMN2 Q16637 3/20 0.55
NPC1 O15118 2/20 0.51
PIM1 P11309 1/20 0.50
PIM2 Q9P1W9 1/20 0.50
MAPK1 P28482 4/20 0.47
POLB P06746 3/20 0.47
ALDH1A1 P00352 2/20 0.47
LMNA P02545 2/20 0.47
HPGD P15428 2/20 0.47
RAB9A P51151 2/20 0.47
KDM4E B2RXH2 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
CSNK2A2 P19784 1/20 0.43
CSNK2B P67870 1/20 0.43
CSNK2A1 P68400 1/20 0.43
CSNK2A3 Q8NEV1 1/20 0.43

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
SCHEMBL10497412 0.87 MAPT (0.65) MAPTMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL10497489 0.87 MAPT (0.65) MAPTMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL14668178 0.78 MAPT (0.43) MAPTMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL10497819 0.78 TYR (0.62) MAPTMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL5580044 0.77 TYR (0.52) MAPTMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL5580045 0.77 TYR (0.52) MAPTMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL10498227 0.75 PIM1 (0.47) MAPTMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL10497466 0.75 MEN1 (0.61) MAPTMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL4067532 0.75 MAPT (0.48) MAPTMEN1KMT2ANPC1PIM1
SCHEMBL30301081 0.75 MAPT (0.48) MAPTMEN1KMT2ANPC1PIM1

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
EP-0328669-A1 CHALCONE DERIVATIVE COMPOUNDS NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1989-08-23 EP claimed