SCHEMBL5458458

SCHEMBL5458458

NC(=O)c1c(NC(=O)Nc2ncccn2)sc2c1CCOC2

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CFTR P13569 1/20 0.57
PTPRC P08575 1/20 0.49
PTPN2 P17706 1/20 0.49
PTPN1 P18031 1/20 0.49
PTPRB P23467 1/20 0.49
PTPRE P23469 1/20 0.49
FLT3 P36888 3/20 0.48
KCNH2 Q12809 3/20 0.47
NPC1 O15118 4/20 0.45
RAB9A P51151 4/20 0.45
HPGD P15428 2/20 0.45
RAB7A P51149 1/20 0.45
MEN1 O00255 1/20 0.45
EPHB4 P54760 1/20 0.45
KMT2A Q03164 1/20 0.45
CNR1 P21554 3/20 0.44
CNR2 P34972 3/20 0.44
ANO1 Q5XXA6 3/20 0.43
ALDH1A1 P00352 5/20 0.43
MAPT P10636 3/20 0.43

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
SCHEMBL5453663 0.84 HPGD (0.54) CFTRPTPRCPTPN2PTPN1PTPRB
SCHEMBL5453210 0.83 CFTR (0.59) CFTRPTPRCPTPN2PTPN1PTPRB
SCHEMBL5455947 0.83 MEN1 (0.65) CFTRPTPRCPTPN2PTPN1PTPRB
SCHEMBL5463139 0.82 CFTR (0.55) CFTRPTPRCPTPN2PTPN1PTPRB
SCHEMBL5460329 0.82 CFTR (0.62) CFTRPTPRCPTPN2PTPN1PTPRB
SCHEMBL5449075 0.80 CFTR (0.66) CFTRPTPRCPTPN2PTPN1PTPRB
SCHEMBL5448477 0.80 CFTR (0.58) CFTRPTPRCPTPN2PTPN1PTPRB
SCHEMBL5458932 0.80 CFTR (0.58) CFTRPTPRCPTPN2PTPN1PTPRB
SCHEMBL5453229 0.80 CFTR (0.51) CFTRPTPRCPTPN2PTPN1PTPRB
SCHEMBL16962264 0.80 KCNH2 (0.68) CFTRPTPRCPTPN2PTPN1PTPRB

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 4 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

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 CFTR 2030/4885PTPRC 1457/4885PTPN2 2364/4885

“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.