SCHEMBL5557339

SCHEMBL5557339

O=C(NCCCCCCNC(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1)NCc1cccnc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FES P07332 1/20 0.61
RET P07949 1/20 0.61
MARK3 P27448 1/20 0.61
TYK2 P29597 1/20 0.61
FLT4 P35916 1/20 0.61
SYK P43405 1/20 0.61
CLK2 P49760 1/20 0.61
CLK4 Q9HAZ1 1/20 0.61
MEN1 O00255 2/20 0.58
KMT2A Q03164 2/20 0.58
CNR1 P21554 2/20 0.58
CNR2 P34972 2/20 0.58
NAMPT P43490 2/20 0.49
LMNA P02545 2/20 0.48
EPHX1 P07099 1/20 0.48
EPHX2 P34913 1/20 0.48
HPGD P15428 1/20 0.47
HTT P42858 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
SLC1A2 P43004 1/20 0.47

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
SCHEMBL5553003 0.86 FES (0.58) FESRETMARK3TYK2FLT4
SCHEMBL5557341 0.80 KMT2A (0.60) MEN1KMT2ACNR1CNR2NAMPT
SCHEMBL5557494 0.79 FES (0.76) FESRETMARK3TYK2FLT4
SCHEMBL18317601 0.78 FLT4 (1.00) FESRETMARK3TYK2FLT4
SCHEMBL18317211 0.78 FLT4 (1.00) FESRETMARK3TYK2FLT4
SCHEMBL18317214 0.78 FLT4 (1.00) FESRETMARK3TYK2FLT4
SCHEMBL18317546 0.78 FLT4 (1.00) FESRETMARK3TYK2FLT4
SCHEMBL18334816 0.78 FLT4 (1.00) FESRETMARK3TYK2FLT4
SCHEMBL18317996 0.78 FLT4 (1.00) FESRETMARK3TYK2FLT4
SCHEMBL1514550 0.78 FLT4 (1.00) FESRETMARK3TYK2FLT4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1154998-B1 INHIBITORS OF CELLULAR NIACINAMIDE MONONUCLEOTIDE FORMATION AND THEIR USE IN CANCER THERAPY ASTELLAS DEUTSCHLAND GMBH (DE) 2007-09-26 EP claimed
US-6506572-B2 Inhibitor of niacinamide phosphoribosyl transferase (NAPRT) KLINGE PHARMA GMBH (DE) 2003-01-14 US claimed
JP-2002537380-A 2002-11-05 JP claimed
US-20020160968-A1 Inhibitors of cellular niacinamide mononucleotide formation and their use in cancer therapy KLINGE PHARMA GMBH 2002-10-31 US claimed
EP-1154998-A1 INHIBITORS OF CELLULAR NIACINAMIDE MONONUCLEOTIDE FORMATION AND THEIR USE IN CANCER THERAPY Klinge Pharma GmbH (DE) 2001-11-21 EP claimed
WO-2000050399-A1 INHIBITORS OF CELLULAR NIACINAMIDE MONONUCLEOTIDE FORMATION AND THEIR USE IN CANCER THERAPY KLINGE PHARMA GMBH (DE) 2000-08-31 WO claimed
EP-1031564-A1 Inhibitors of cellular nicotinamide mononucleotide formation and their use in cancer therapy Klinge Pharma GmbH (DE) 2000-08-30 EP claimed
EP-1154998-B1 INHIBITORS OF CELLULAR NIACINAMIDE MONONUCLEOTIDE FORMATION AND THEIR USE IN CANCER THERAPY ASTELLAS DEUTSCHLAND GMBH (DE) 2007-09-26 EP disclosed
EP-1816124-A2 Inhibitors of cellular niacinamide mononucleotide formation and their use in cancer therapy Astellas Deutschland GmbH (DE) 2007-08-08 EP disclosed
EP-1816124-A2 Inhibitors of cellular niacinamide mononucleotide formation and their use in cancer therapy Astellas Deutschland GmbH (DE) 2007-08-08 EP 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 (1 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-20020160968-A1 Inhibitors of cellular niacinamide mononucleotide formation and their use in cancer therapy NAMPT, NAPRT, NNT FES 3610/4885RET 3557/4885MARK3 4193/4885

“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.