SCHEMBL353757

SCHEMBL353757

CC(=O)Nc1ccc2c(c1)c(=O)c1ccccc1n2CCCCCC(=O)ON1C(=O)CCC1=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.49
MAPT P10636 5/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
THRB P10828 1/20 0.49
NPSR1 Q6W5P4 1/20 0.47
TP53 P04637 4/20 0.47
KDM4E B2RXH2 1/20 0.47
MEN1 O00255 1/20 0.47
USP2 O75604 1/20 0.47
KMT2A Q03164 1/20 0.47
RXFP1 Q9HBX9 2/20 0.42
HDAC1 Q13547 3/20 0.42
HDAC6 Q9UBN7 3/20 0.42
HDAC3 O15379 1/20 0.42
HDAC4 P56524 1/20 0.42
HDAC7 Q8WUI4 1/20 0.42
HDAC2 Q92769 1/20 0.42
HDAC10 Q969S8 1/20 0.42
HDAC11 Q96DB2 1/20 0.42
HDAC8 Q9BY41 1/20 0.42

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
SCHEMBL353790 0.86 HDAC1 (0.51) MAPTSMN1; SMN2TP53HDAC1HDAC6
SCHEMBL13036112 0.84 KMT2A (0.52) NPC1MAPTSMN1; SMN2THRBNPSR1
SCHEMBL353722 0.84 HDAC1 (0.46) MAPTSMN1; SMN2THRBTP53RXFP1
SCHEMBL354757 0.83 FABP4 (0.57) NPC1MAPTSMN1; SMN2THRBNPSR1
SCHEMBL357128 0.81 HDAC1 (0.41) MAPTSMN1; SMN2THRBTP53RXFP1
SCHEMBL354525 0.78 HSD17B10 (0.40) SMN1; SMN2HDAC1HDAC6HDAC3HDAC4
SCHEMBL6152416 0.75 MAPT (0.51) NPC1MAPTSMN1; SMN2THRBNPSR1
SCHEMBL14160797 0.73 NPC1 (0.68) NPC1MAPTSMN1; SMN2THRBNPSR1
SCHEMBL951235 0.73 MEN1 (0.35) MAPTSMN1; SMN2KDM4EMEN1USP2
SCHEMBL357129 0.71 FABP4 (0.51) MAPTSMN1; SMN2TP53HDAC1HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8334387-B2 Method for measuring aromatase activity GE HEALTHCARE UK LIMITED (GB) 2012-12-18 US disclosed
US-8334387-B2 Method for measuring aromatase activity GE HEALTHCARE UK LIMITED (GB) 2012-12-18 US disclosed
US-20120015373-A1 ACRIDONE DERIVATIVES AS LABELS FOR FLUORESCENCE DETECTION OF TARGET MATERIALS GE HEALTHCARE UK LIMITED (GB) 2012-01-19 US disclosed
US-20120015373-A1 ACRIDONE DERIVATIVES AS LABELS FOR FLUORESCENCE DETECTION OF TARGET MATERIALS GE HEALTHCARE UK LIMITED (GB) 2012-01-19 US disclosed
US-8034558-B2 Incubating dye of given formula with biological material, measuring fluorescence lifetime; lectins/glycoproteins, biotin/streptavidin, DNA/RNA GE HEALTHCARE UK LIMITED (GB) 2011-10-11 US disclosed
US-8034558-B2 Incubating dye of given formula with biological material, measuring fluorescence lifetime; lectins/glycoproteins, biotin/streptavidin, DNA/RNA GE HEALTHCARE UK LIMITED (GB) 2011-10-11 US disclosed
US-20110014641-A1 METHOD FOR MEASURING AROMATASE ACTIVITY GE HEALTHCARE UK LIMITED (GB) 2011-01-20 US disclosed
US-20110014641-A1 METHOD FOR MEASURING AROMATASE ACTIVITY GE HEALTHCARE UK LIMITED (GB) 2011-01-20 US disclosed
US-20100184098-A1 METHODS FOR MEASURING ENZYME ACTIVITY GE HEALTHCARE UK LIMITED (GB) 2010-07-22 US disclosed
US-20100184098-A1 METHODS FOR MEASURING ENZYME ACTIVITY GE HEALTHCARE UK LIMITED (GB) 2010-07-22 US disclosed
US-7727739-B2 Methods for measuring enzyme activity GE HEALTHCARE UK LIMITED (GB) 2010-06-01 US disclosed
US-7727739-B2 Methods for measuring enzyme activity GE HEALTHCARE UK LIMITED (GB) 2010-06-01 US disclosed
US-20080139788-A1 ACRIDONE DERIVATIVES AS LABELS FOR FLUORESCENCE DETECTION OF TARGET MATERIALS GE HEALTHCARE UK LIMITED (GB) 2008-06-12 US disclosed
US-20080139788-A1 ACRIDONE DERIVATIVES AS LABELS FOR FLUORESCENCE DETECTION OF TARGET MATERIALS GE HEALTHCARE UK LIMITED (GB) 2008-06-12 US disclosed
US-20070184429-A1 Method for measuring aromatase activity GE HEALTHCARE UK LIMITED (GB) 2007-08-09 US disclosed
US-20070184429-A1 Method for measuring aromatase activity GE HEALTHCARE UK LIMITED (GB) 2007-08-09 US disclosed
EP-1497453-B1 METHODS FOR MEASURING PROTEIN KINASE AND PHOSPHATASE ACTIVITY GE HEALTHCARE UK LTD (GB) 2007-06-13 EP disclosed
US-7125682-B2 Methods for measuring protein kinase and phosphatase activity GE HEALTHCARE UK LIMITED (GB) 2006-10-24 US disclosed
US-20040191792-A1 Acridone derivatives as labels for fluorescence detection of target materials GE HEALTHCARE UK LIMITED (GB) 2004-09-30 US disclosed
US-20030228646-A1 Methods for measuring protein kinase and phosphatase activity TTP LABTECH LIMITED (GB) 2003-12-11 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080139788-A1 ACRIDONE DERIVATIVES AS LABELS FOR FLUORESCENCE DETECTION OF TARGET MATERIALS ACR, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, ARSA NPC1 3924/4885MAPT 4659/4885SMN1; SMN2 4300/4885
US-20110014641-A1 METHOD FOR MEASURING AROMATASE ACTIVITY CYP19A1, CYP17A1, CYP21A2 NPC1 3129/4885MAPT 4572/4885SMN1; SMN2 4541/4885
US-20040191792-A1 Acridone derivatives as labels for fluorescence detection of target materials ACR, ARSA, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 NPC1 3978/4885MAPT 4679/4885SMN1; SMN2 4194/4885
US-20070184429-A1 Method for measuring aromatase activity CYP19A1, CYP17A1, CYP21A2 NPC1 3129/4885MAPT 4572/4885SMN1; SMN2 4541/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.