SCHEMBL11054368

SCHEMBL11054368

Cc1ccc2[nH]c(-c3c(-c4ccccc4)noc3C)c(C(=O)C(=O)N(C)C)c2c1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.42
MEN1 O00255 2/20 0.42
HTT P42858 2/20 0.42
ALDH1A1 P00352 2/20 0.42
HPGD P15428 2/20 0.42
KDM4E B2RXH2 1/20 0.42
GFER P55789 1/20 0.42
HSD17B10 Q99714 1/20 0.42
PADI4 Q9UM07 1/20 0.41
BRD4 O60885 1/20 0.41
PTGS1 P23219 1/20 0.41
PTGS2 P35354 1/20 0.41
MAPT P10636 2/20 0.41
LMNA P02545 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41

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
SCHEMBL10832100 0.91 ALDH1A1 (0.50) KMT2AMEN1HTTALDH1A1PTGS1
SCHEMBL11053638 0.90 GAA (0.43)
SCHEMBL11054882 0.89 TUBB4A (0.46) KMT2AMEN1HTTALDH1A1HPGD
SCHEMBL11049245 0.88 PADI4 (0.45) KMT2AMEN1HTTALDH1A1HPGD
SCHEMBL10986261 0.82
SCHEMBL11054385 0.78 CSF1R (0.46) KMT2AMEN1HTTPADI4BRD4
SCHEMBL11054892 0.78 KMT2A (0.51) KMT2AMEN1HTTALDH1A1PTGS1
SCHEMBL10986271 0.78 ALDH1A1 (0.45) ALDH1A1HSD17B10CYP1A2CYP2D6CYP2C19
SCHEMBL11046939 0.77 TUBB4A (0.48) KMT2AMEN1HTTALDH1A1HPGD
SCHEMBL10832434 0.77 GAA (0.47) KMT2AMEN1HTTBRD4PTGS1

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
US-4453001-A ANTIDIABETIC AGENTS SANDOZ, INC. (US) 1984-06-05 US disclosed
US-4415568-A ANTIDIABETIC AND HYPOGLYCEMIC AGENTS SANDOZ, INC. (US) 1983-11-15 US disclosed
US-4336378-A ANTIDIABETIC AGENTS SANDOZ, INC. (US) 1982-06-22 US disclosed