SCHEMBL5455489

SCHEMBL5455489

COc1cccc(NC(=O)Nc2sc3c(c2C(N)=O)CCOC3)c1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CFTR P13569 1/20 0.55
FLT3 P36888 3/20 0.55
RXFP1 Q9HBX9 1/20 0.52
RAB9A P51151 4/20 0.51
NPC1 O15118 3/20 0.51
KMT2A Q03164 3/20 0.51
MEN1 O00255 1/20 0.51
EPHB4 P54760 1/20 0.51
CXCR2 P25025 2/20 0.49
KCNH2 Q12809 2/20 0.48
TNIK Q9UKE5 1/20 0.47
TP53 P04637 1/20 0.46
TSHR P16473 1/20 0.46
CASP3 P42574 1/20 0.46
SENP7 Q9BQF6 1/20 0.46
PTGER4 P35408 2/20 0.46

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
SCHEMBL5453424 0.88 CFTR (0.59) CFTRFLT3RAB9ANPC1KMT2A
SCHEMBL5451652 0.87 CFTR (0.60) CFTRFLT3RAB9ANPC1KMT2A
SCHEMBL5466862 0.86 CFTR (0.57) CFTRFLT3RAB9ANPC1KMT2A
SCHEMBL5446246 0.86 FLT3 (0.73) FLT3RXFP1RAB9AKMT2AMEN1
SCHEMBL5467205 0.86 CFTR (0.56) CFTRFLT3RAB9ANPC1KMT2A
SCHEMBL5448351 0.85 CFTR (0.55) CFTRRAB9ANPC1KMT2AMEN1
SCHEMBL5457654 0.85 CFTR (0.55) CFTRFLT3RAB9ANPC1KMT2A
SCHEMBL5454365 0.85 CFTR (0.55) CFTRRAB9ANPC1KMT2AMEN1
SCHEMBL5458044 0.85 CFTR (0.57) CFTRRAB9ANPC1KMT2AMEN1
SCHEMBL5449672 0.85 CFTR (0.55) CFTRRAB9ANPC1KMT2AMEN1

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 2030/4885FLT3 3509/4885RXFP1 4595/4885

“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.