SCHEMBL5457892

SCHEMBL5457892

CCOc1ccc(NC(=O)Nc2sc3c(c2C(N)=O)CCOC3)cc1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CFTR P13569 1/20 0.56
KCNH2 Q12809 10/20 0.53
TNIK Q9UKE5 1/20 0.50
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
EPHB4 P54760 1/20 0.49
CXCR2 P25025 1/20 0.49
ANO1 Q5XXA6 1/20 0.48
TLR2 O60603 2/20 0.48
FLT3 P36888 1/20 0.47
GAA P10253 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
SCHEMBL5453175 0.92 CFTR (0.54) CFTRKCNH2TNIKMEN1KMT2A
SCHEMBL5447192 0.90 CFTR (0.52) CFTRKCNH2TNIKMEN1KMT2A
SCHEMBL5453424 0.89 CFTR (0.59) CFTRKCNH2MEN1KMT2ANPC1
SCHEMBL5458242 0.87 CFTR (0.59) CFTRKCNH2TNIKMEN1KMT2A
SCHEMBL5465704 0.87 NPC1 (0.51) CFTRKCNH2TNIKMEN1KMT2A
SCHEMBL5448626 0.87 CFTR (0.56) CFTRKCNH2TNIKMEN1KMT2A
SCHEMBL5449304 0.86 CFTR (0.65) CFTRKCNH2TNIKMEN1KMT2A
SCHEMBL5457809 0.85 MEN1 (0.55) CFTRKCNH2TNIKMEN1KMT2A
SCHEMBL16962264 0.84 KCNH2 (0.68) CFTRKCNH2MEN1KMT2ANPC1
SCHEMBL5446177 0.84 CFTR (0.60) CFTRKCNH2TNIKMEN1KMT2A

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 2 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
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 2030/4885KCNH2 3409/4885TNIK 4134/4885

“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.