SCHEMBL5459999

SCHEMBL5459999

CCCCNCC(=O)Nc1sc2c(c1C(N)=O)CCOC2

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CFTR P13569 1/20 0.54
ALDH1A1 P00352 3/20 0.54
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
RAB9A P51151 1/20 0.54
MAPK10 P53779 1/20 0.54
CNR2 P34972 7/20 0.50
KDM4E B2RXH2 2/20 0.49
FLT3 P36888 2/20 0.49
MAPK1 P28482 1/20 0.49
ANO1 Q5XXA6 1/20 0.48
NPSR1 Q6W5P4 1/20 0.47
ALOX15 P16050 1/20 0.47
HSD17B10 Q99714 1/20 0.47
PTPRC P08575 1/20 0.46
PTPN2 P17706 1/20 0.46
PTPN1 P18031 1/20 0.46
PTPRB P23467 1/20 0.46
PTPRE P23469 1/20 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
SCHEMBL5451710 0.89 CFTR (0.58) CFTRALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL5463020 0.83 CFTR (0.55) CFTRALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL5460509 0.83 CFTR (0.53) CFTRALDH1A1SMN1; SMN2RAB9AMAPK10
SCHEMBL5445049 0.82 CFTR (0.60) CFTRALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL5458688 0.81 SMN1; SMN2 (0.61) CFTRALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL5449159 0.81 HSD17B10 (0.56) CFTRALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL8290653 0.80 CFTR (0.67) CFTRALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL5448448 0.80 CFTR (0.55) CFTRALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL5467640 0.80 CFTR (0.58) CFTRALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL5460139 0.79 CFTR (0.60) CFTRALDH1A1MEN1KMT2ASMN1; SMN2

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 2030/4885ALDH1A1 1153/4885MEN1 2891/4885

“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.