SCHEMBL8887295

SCHEMBL8887295

CC(=O)c1ccc(Cc2c(-c3ccccc3)n[nH]c2-c2ccccc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.54
KMT2A Q03164 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.46
MAPT P10636 3/20 0.46
MEN1 O00255 1/20 0.44
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 2/20 0.42
GAA P10253 2/20 0.42
HPGD P15428 2/20 0.42
RAB9A P51151 2/20 0.42
TP53 P04637 2/20 0.42
NPC1 O15118 1/20 0.42
HSD17B10 Q99714 1/20 0.42
HDAC6 Q9UBN7 1/20 0.41
CA2 P00918 1/20 0.41
GLA P06280 1/20 0.41
MAP2K4 P45985 1/20 0.40
POLB P06746 1/20 0.39

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
SCHEMBL7996516 0.77 RPS6KA3 (0.47) KMT2ASMN1; SMN2MEN1KDM4EALDH1A1
SCHEMBL17279842 0.77 HPGD (0.45) SMN1; SMN2MAPTKDM4EALDH1A1GAA
SCHEMBL11242632 0.75 KDM4E (0.50) LMNAKMT2ASMN1; SMN2MEN1KDM4E
SCHEMBL8888564 0.74 ADORA3 (0.45) KMT2ASMN1; SMN2MAPTMEN1KDM4E
SCHEMBL9474883 0.74 LMNA (0.81) LMNAKMT2ASMN1; SMN2MAPTKDM4E
SCHEMBL5216372 0.74 CDK4 (0.50) LMNAKMT2ASMN1; SMN2MAPTMEN1
SCHEMBL22769602 0.73 KDM4E (0.45) LMNAKMT2ASMN1; SMN2MEN1KDM4E
SCHEMBL8889764 0.73 SMN1; SMN2 (0.51) LMNAKMT2ASMN1; SMN2MAPTKDM4E
SCHEMBL22784055 0.73 MAP2K4 (0.49) KMT2ASMN1; SMN2MAPTMEN1KDM4E
SCHEMBL12567890 0.73 ALDH1A1 (0.55) SMN1; SMN2MAPTKDM4EALDH1A1GAA

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
WO-1997001551-A1 PYRAZOLE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-01-16 WO disclosed