SCHEMBL355330

SCHEMBL355330

CCOC(=O)CCCCCn1c2ccccc2c(=O)c2cc(N)ccc21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNF P01375 3/20 0.53
PSEN1 P49768 1/20 0.50
PSEN2 P49810 1/20 0.50
APH1B Q8WW43 1/20 0.50
NCSTN Q92542 1/20 0.50
APH1A Q96BI3 1/20 0.50
PSENEN Q9NZ42 1/20 0.50
SMN1; SMN2 Q16637 3/20 0.49
MAPT P10636 3/20 0.49
TP53 P04637 1/20 0.49
KDM4E B2RXH2 2/20 0.48
SLC6A4 P31645 2/20 0.47
SLC6A2 P23975 1/20 0.47
HRH1 P35367 1/20 0.47
CTNNB1 P35222 1/20 0.47
CNR2 P34972 2/20 0.46
HDAC3 O15379 1/20 0.46
HDAC4 P56524 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC7 Q8WUI4 1/20 0.46

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
SCHEMBL355499 0.90 TNF (0.62) TNFPSEN1PSEN2APH1BNCSTN
SCHEMBL354801 0.87 RXFP1 (0.55) TNFPSEN1PSEN2APH1BNCSTN
SCHEMBL354741 0.87 TNF (0.53) TNFPSEN1PSEN2APH1BNCSTN
SCHEMBL355062 0.86 PSEN1 (0.54) TNFPSEN1PSEN2APH1BNCSTN
SCHEMBL354539 0.84 FABP4 (0.64) SMN1; SMN2MAPTTP53KDM4ESLC6A4
SCHEMBL1004476 0.84 TNF (0.63) TNFPSEN1PSEN2APH1BNCSTN
SCHEMBL1004093 0.84 TNF (0.63) TNFPSEN1PSEN2APH1BNCSTN
SCHEMBL352528 0.84 MAPT (0.51) TNFPSEN1PSEN2APH1BNCSTN
SCHEMBL12938925 0.83 TNF (0.64) TNFPSEN1PSEN2APH1BNCSTN
SCHEMBL353749 0.81 SMN1; SMN2 (0.49) TNFPSEN1PSEN2APH1BNCSTN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-20110039289-A1 FLUOROGENIC PEPTIDES AND THEIR METHOD OF PRODUCTION ASSAYMETRICS LIMITED (GB) 2011-02-17 US disclosed
EP-2268656-A1 FLUOROGENIC PEPTIDES AND THEIR METHOD OF PRODUCTION Assaymetrics Limited (GB) 2011-01-05 EP disclosed
WO-2009112791-A1 FLUOROGENIC PEPTIDES AND THEIR METHOD OF PRODUCTION ASSAYMETRICS LIMITED (GB) 2009-09-17 WO 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-20040191792-A1 Acridone derivatives as labels for fluorescence detection of target materials GE HEALTHCARE UK LIMITED (GB) 2004-09-30 US disclosed
EP-1392776-A2 ACRIDONE DERIVATIVES AS LABELS FOR FLUORESCENCE DETECTION OF TARGET MATERIALS Amersham Biosciences UK Limited (GB) 2004-03-03 EP disclosed
WO-2002099424-A2 ACRIDONE DERIVATIVES AS LABELS FOR FLUORESCENCE DETECTION OF TARGET MATERIALS AMERSHAM BIOSCIENCES UK LIMITED (GB) 2002-12-12 WO 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 (3 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-20110039289-A1 FLUOROGENIC PEPTIDES AND THEIR METHOD OF PRODUCTION ACR, DNPEP, FIBP TNF 1902/4885PSEN1 4485/4885PSEN2 4540/4885
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 TNF 4339/4885PSEN1 4493/4885PSEN2 4558/4885
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 TNF 4012/4885PSEN1 4639/4885PSEN2 4753/4885

“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.