SCHEMBL5455859

SCHEMBL5455859

NC(=O)c1c(NC(=O)CCCOc2ccccc2)sc2c1CCCC2

nearest known ligand 0.81

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.81
TP53 P04637 2/20 0.81
FLT3 P36888 5/20 0.70
LMNA P02545 1/20 0.67
HPGD P15428 1/20 0.67
RAB9A P51151 2/20 0.62
MEN1 O00255 1/20 0.62
ALDH1A1 P00352 1/20 0.62
MAPK10 P53779 1/20 0.62
KMT2A Q03164 1/20 0.62
SMN1; SMN2 Q16637 1/20 0.62
NPC1 O15118 1/20 0.60
RXFP1 Q9HBX9 2/20 0.60
THRB P10828 1/20 0.59
POLB P06746 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59

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
SCHEMBL8290738 0.90 MAPT (1.00) MAPTTP53FLT3LMNAHPGD
SCHEMBL8290598 0.88 MAPT (0.80) MAPTTP53FLT3LMNAHPGD
SCHEMBL5451377 0.88 FLT3 (0.80) MAPTTP53FLT3LMNARAB9A
SCHEMBL5460093 0.85 FLT3 (0.87) MAPTTP53FLT3LMNAHPGD
SCHEMBL8288667 0.84 MAPT (1.00) MAPTTP53HPGDALDH1A1SMN1; SMN2
SCHEMBL4135422 0.84 HPGD (0.83) MAPTTP53FLT3LMNAHPGD
SCHEMBL21045321 0.83 FLT3 (0.83) MAPTTP53FLT3LMNAHPGD
SCHEMBL8290726 0.82 FLT3 (1.00) MAPTFLT3LMNAHPGDRAB9A
SCHEMBL12632694 0.81 FLT3 (0.98) MAPTTP53FLT3LMNAHPGD
SCHEMBL21045428 0.80 FLT3 (0.95) MAPTFLT3LMNAHPGDRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070275962-A1 Heterobicyclic Compounds as Pharmaceutically Active Agents GPC BIOTECH AG (DE) 2007-11-29 US claimed
EP-1670804-A2 HETEROBICYCLIC COMPOUNDS AS PHARMACEUTICALLY ACTIVE AGENTS GPC Biotech AG (DE) 2006-06-21 EP claimed
WO-2005023818-A2 HETEROBICYCLIC COMPOUNDS AS PHARMACEUTICALLY ACTIVE AGENTS GPC BIOTECH AG (DE) 2005-03-17 WO claimed
US-20070275962-A1 Heterobicyclic Compounds as Pharmaceutically Active Agents GPC BIOTECH AG (DE) 2007-11-29 US disclosed
WO-2005033102-A2 THIOPHENE-BASED COMPOUNDS EXHIBITING ATP-UTILIZING ENZYME INHIBITORY ACTIVITY, AND COMPOSITIONS, AND USES THEREOF AMPHORA DISCOVERY CORPORATION (US) 2005-04-14 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 (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-20070275962-A1 Heterobicyclic Compounds as Pharmaceutically Active Agents TBCA, PARK7, NFATC1 MAPT 21/4885TP53 2520/4885FLT3 3509/4885

“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.