SCHEMBL5459851

SCHEMBL5459851

NC(=O)c1c(NC(=O)C2CC2)sc2cc(OCC(=O)N3CCOCC3)ccc12

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 8/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
POLB P06746 3/20 0.44
TP53 P04637 3/20 0.44
MAPT P10636 3/20 0.44
ALDH1A1 P00352 3/20 0.44
KDM4E B2RXH2 2/20 0.44
HPGD P15428 2/20 0.44
RECQL P46063 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
LMNA P02545 1/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL5453440 0.89 GAA (0.44) SMN1; SMN2POLBTP53MAPTALDH1A1
SCHEMBL5456020 0.82 MAPT (0.41) SMN1; SMN2MAPTALDH1A1KDM4EHPGD
SCHEMBL5449196 0.82 ABL1 (0.50) MAPT
SCHEMBL5460935 0.81 MAPT (0.42) POLBMAPTMEN1KMT2AHTT
SCHEMBL5451020 0.81 ABL1 (0.49) SMN1; SMN2POLBTP53MAPTALDH1A1
SCHEMBL5453194 0.81 ALDH1A1 (0.41) POLBMAPTALDH1A1MEN1KMT2A
SCHEMBL5451194 0.80 POLB (0.40) POLBTP53MAPTALDH1A1HPGD
SCHEMBL5453479 0.79 TNIK (0.37) MAPTALDH1A1RECQLMEN1KMT2A
SCHEMBL5454161 0.79 FLT3 (0.41) TP53MAPTHTT
SCHEMBL5451669 0.78 ESR1 (0.51) TP53MAPTALDH1A1RECQLMEN1

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 FKBP1A 777/4885SMN1; SMN2 2157/4885POLB 404/4885

“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.