SCHEMBL5449705

SCHEMBL5449705

CCCCCCCCC1CC1C(=O)Nc1sc2c(c1C(N)=O)CCOC2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CFTR P13569 1/20 0.51
CNR2 P34972 8/20 0.51
ALDH1A1 P00352 6/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
MAPK10 P53779 2/20 0.47
RAB9A P51151 2/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
HPGD P15428 3/20 0.44
TSHR P16473 1/20 0.44
HSD17B10 Q99714 1/20 0.44
MDM2 Q00987 1/20 0.44
KDM4E B2RXH2 2/20 0.44
MAPT P10636 2/20 0.44
CNR1 P21554 1/20 0.44
HTT P42858 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
FLT3 P36888 2/20 0.43
PTPRC P08575 1/20 0.43
PTPN2 P17706 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
SCHEMBL14361079 0.88 CFTR (0.56) CFTRCNR2ALDH1A1SMN1; SMN2MAPK10
SCHEMBL5450939 0.84 CFTR (0.54) CFTRCNR2ALDH1A1SMN1; SMN2MAPK10
SCHEMBL5453253 0.83 CFTR (0.53) CFTRCNR2ALDH1A1SMN1; SMN2MAPK10
SCHEMBL5460372 0.83 CNR2 (0.54) CFTRCNR2ALDH1A1SMN1; SMN2MAPK10
SCHEMBL5460380 0.81 CFTR (0.60) CFTRCNR2ALDH1A1SMN1; SMN2MAPK10
SCHEMBL5452084 0.79 ALDH1A1 (0.55) CFTRCNR2ALDH1A1SMN1; SMN2MAPK10
SCHEMBL5460250 0.79 CFTR (0.49) CFTRCNR2ALDH1A1SMN1; SMN2MAPK10
SCHEMBL5466126 0.79 CFTR (0.57) CFTRCNR2ALDH1A1SMN1; SMN2MAPK10
SCHEMBL5448448 0.79 CFTR (0.55) CFTRCNR2ALDH1A1SMN1; SMN2MAPK10
SCHEMBL5452074 0.77 CFTR (0.56) CFTRCNR2ALDH1A1SMN1; SMN2MAPK10

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 2030/4885CNR2 2272/4885ALDH1A1 1153/4885

“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.