SCHEMBL5453467

SCHEMBL5453467

CCC(=O)Nc1sc2c(c1C(N)=O)CCCC2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 4/20 1.00
KDM4E B2RXH2 2/20 0.94
MAPK1 P28482 1/20 0.94
ALDH1A1 P00352 7/20 0.72
MEN1 O00255 2/20 0.72
KMT2A Q03164 2/20 0.72
SMN1; SMN2 Q16637 2/20 0.72
RAB9A P51151 1/20 0.72
MAPK10 P53779 1/20 0.72
CYP1A2 P05177 1/20 0.72
CYP2C19 P33261 1/20 0.72
TSHR P16473 4/20 0.71
LMNA P02545 3/20 0.71
MAPT P10636 2/20 0.71
L3MBTL1 Q9Y468 2/20 0.71
GFER P55789 1/20 0.71
HTT P42858 1/20 0.70
HPGD P15428 4/20 0.68
GAA P10253 1/20 0.68
HSD17B10 Q99714 2/20 0.67

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
SCHEMBL8289412 0.97 KDM4E (1.00) FLT3KDM4EMAPK1ALDH1A1MEN1
SCHEMBL5465217 0.89 ALDH1A1 (0.81) FLT3KDM4EMAPK1ALDH1A1MEN1
SCHEMBL5457782 0.87 ALDH1A1 (0.95) FLT3KDM4EMAPK1ALDH1A1MEN1
SCHEMBL5467546 0.86 FLT3 (0.76) FLT3KDM4EMAPK1ALDH1A1MEN1
SCHEMBL4135422 0.86 HPGD (0.83) FLT3KDM4EMAPK1ALDH1A1MEN1
SCHEMBL1007246 0.86 FLT3 (0.75) FLT3KDM4EMAPK1ALDH1A1MEN1
SCHEMBL20541804 0.86 FLT3 (0.75) FLT3KDM4EMAPK1ALDH1A1MEN1
SCHEMBL3453042 0.86 FLT3 (0.75) FLT3KDM4EMAPK1ALDH1A1MEN1
SCHEMBL3125764 0.85 ALDH1A1 (0.88) FLT3KDM4EMAPK1ALDH1A1MEN1
SCHEMBL5462770 0.85 FLT3 (0.74) FLT3KDM4EMAPK1ALDH1A1MEN1

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 FLT3 3509/4885KDM4E 3417/4885MAPK1 1176/4885

“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.