SCHEMBL5456392

SCHEMBL5456392

NC(=O)c1c(NC(=S)Nc2cccnc2)sc2c1CCOC2

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 6/20 0.57
ALDH1A1 P00352 7/20 0.56
MAPT P10636 4/20 0.56
GAA P10253 4/20 0.56
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
LMNA P02545 2/20 0.56
CFTR P13569 1/20 0.53
RAB7A P51149 1/20 0.52
RAB9A P51151 3/20 0.51
NPC1 O15118 2/20 0.51
FLT3 P36888 1/20 0.51
POLB P06746 1/20 0.50
KDM4E B2RXH2 2/20 0.46
RXFP1 Q9HBX9 1/20 0.46
ANO1 Q5XXA6 1/20 0.44
PTPRC P08575 1/20 0.43
PTPN2 P17706 1/20 0.43
PTPN1 P18031 1/20 0.43
PTPRB P23467 1/20 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
SCHEMBL5463139 0.90 CFTR (0.55) CXCR2ALDH1A1MAPTGAAMEN1
SCHEMBL5457899 0.86 ALDH1A1 (0.76) CXCR2ALDH1A1MAPTGAAMEN1
SCHEMBL5448486 0.82 CXCR2 (0.59) CXCR2ALDH1A1MAPTGAAMEN1
SCHEMBL5447419 0.79 CXCR2 (0.58) CXCR2ALDH1A1MAPTGAAMEN1
SCHEMBL5456402 0.79 CFTR (0.43) CXCR2ALDH1A1MAPTGAAMEN1
SCHEMBL5453210 0.77 CFTR (0.59) CXCR2ALDH1A1MAPTMEN1KMT2A
SCHEMBL5455947 0.77 MEN1 (0.65) CXCR2ALDH1A1MAPTGAAMEN1
SCHEMBL5456256 0.75 CFTR (0.61) CXCR2ALDH1A1MAPTGAAMEN1
SCHEMBL5448254 0.75 CFTR (0.55) CXCR2ALDH1A1MAPTGAAMEN1
SCHEMBL5449075 0.74 CFTR (0.66) ALDH1A1MAPTMEN1KMT2ACFTR

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 CXCR2 3255/4885ALDH1A1 1153/4885MAPT 21/4885

“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.