SCHEMBL5453563

SCHEMBL5453563

NC(=O)c1c(NC(=O)Nc2cccc(C(F)(F)F)c2)sc2c1CCOC2

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CFTR P13569 1/20 0.52
MEN1 O00255 2/20 0.48
RAB9A P51151 2/20 0.48
KMT2A Q03164 2/20 0.48
NPC1 O15118 1/20 0.48
EPHB4 P54760 1/20 0.48
ANO1 Q5XXA6 4/20 0.48
MAPT P10636 1/20 0.47
HTT P42858 1/20 0.47
CNR2 P34972 7/20 0.47
CNR1 P21554 5/20 0.47
ALDH1A1 P00352 1/20 0.46
KCNH2 Q12809 1/20 0.46
PDGFRB P09619 1/20 0.46
KDR P35968 1/20 0.46
PTGER4 P35408 1/20 0.46
KCNMA1 Q12791 1/20 0.45

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
SCHEMBL5450945 0.91 CFTR (0.54) CFTRMEN1RAB9AKMT2ANPC1
SCHEMBL5447523 0.88 CFTR (0.56) CFTRMEN1RAB9AKMT2ANPC1
SCHEMBL5454365 0.87 CFTR (0.55) CFTRMEN1RAB9AKMT2ANPC1
SCHEMBL5467447 0.86 MAPT (0.56) MEN1RAB9AKMT2ANPC1ANO1
SCHEMBL5467205 0.86 CFTR (0.56) CFTRMEN1RAB9AKMT2ANPC1
SCHEMBL5458336 0.85 CFTR (0.58) CFTRMEN1RAB9AKMT2ANPC1
SCHEMBL5448351 0.85 CFTR (0.55) CFTRMEN1RAB9AKMT2ANPC1
SCHEMBL5457654 0.85 CFTR (0.55) CFTRMEN1RAB9AKMT2ANPC1
SCHEMBL5451652 0.85 CFTR (0.60) CFTRMEN1RAB9AKMT2ANPC1
SCHEMBL5455947 0.85 MEN1 (0.65) CFTRMEN1RAB9AKMT2ANPC1

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 2030/4885MEN1 2891/4885RAB9A 948/4885

“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.