SCHEMBL5459212

SCHEMBL5459212

COc1ccc2c(c1)C(CC(=O)Nc1sc3c(c1C(N)=O)CCN(C)C3)CC2=O

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.48
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
RAD52 P43351 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
PDE5A O76074 1/20 0.47
ATM Q13315 1/20 0.46
SIGMAR1 Q99720 1/20 0.46
MEN1 O00255 3/20 0.46
FLT3 P36888 2/20 0.45
RXFP1 Q9HBX9 1/20 0.45
TNKS O95271 2/20 0.45
PARP1 P09874 2/20 0.45
TNKS2 Q9H2K2 2/20 0.45

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
SCHEMBL5453351 0.73 RXFP1 (0.49) KMT2ANPC1RAB9ARAD52L3MBTL1
SCHEMBL5453198 0.72 ATM (0.62) KMT2ANPC1RAB9ARAD52ATM
SCHEMBL13485788 0.71 PDE5A (0.67) PDE5ASIGMAR1TNKSPARP1TNKS2
SCHEMBL6461145 0.70 SIGMAR1 (0.53) PDE5ASIGMAR1TNKSPARP1TNKS2
SCHEMBL5460249 0.70 KMT2A (0.65) KMT2ANPC1RAB9AL3MBTL1ATM
SCHEMBL5460132 0.68 L3MBTL1 (0.62) KMT2ANPC1RAB9AL3MBTL1ATM
SCHEMBL1207853 0.68 SIGMAR1 (0.56) KMT2APDE5ASIGMAR1TNKSPARP1
SCHEMBL5458955 0.68 KMT2A (0.63) KMT2ANPC1RAB9AL3MBTL1ATM
SCHEMBL15727649 0.68 PDE5A (0.60) PDE5ASIGMAR1
SCHEMBL503654 0.67 SIGMAR1 (0.57) PDE5AATMSIGMAR1TNKSPARP1

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 KMT2A 4785/4885NPC1 2627/4885RAB9A 948/4885

“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.