SCHEMBL5459048

SCHEMBL5459048

CN1CCc2c(sc(NC(=O)C=CC(=O)Nc3cccc4ccccc34)c2C(N)=O)C1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 12/20 0.59
NPC1 O15118 3/20 0.59
RAB9A P51151 3/20 0.59
MEN1 O00255 5/20 0.56
ATM Q13315 1/20 0.50
MAPT P10636 4/20 0.49
POLB P06746 1/20 0.49
GAA P10253 1/20 0.49
HTT P42858 1/20 0.49
RECQL P46063 1/20 0.49
BLM P54132 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.48
PAX8 Q06710 1/20 0.48
KDM4E B2RXH2 2/20 0.47
FLT3 P36888 1/20 0.47
ALOX15 P16050 1/20 0.47
TSHR P16473 1/20 0.47
HSD17B10 Q99714 1/20 0.47
PSMD14 O00487 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
SCHEMBL5459039 1.00 KMT2A (0.59) KMT2ANPC1RAB9AMEN1ATM
SCHEMBL5453554 0.80 KCNH2 (0.61) KMT2ANPC1RAB9AMEN1ATM
SCHEMBL5453561 0.80 KCNH2 (0.61) KMT2ANPC1RAB9AMEN1ATM
SCHEMBL5465726 0.74 KMT2A (0.63) KMT2ANPC1RAB9AMEN1ATM
SCHEMBL16445880 0.73 KMT2A (0.68) KMT2ANPC1RAB9AMEN1ATM
SCHEMBL10077174 0.73 KMT2A (0.63) KMT2ANPC1RAB9AMEN1ATM
SCHEMBL13151131 0.71 KMT2A (0.68) KMT2ANPC1RAB9AMEN1ATM
SCHEMBL5459968 0.71 KMT2A (0.71) KMT2ANPC1RAB9AMEN1ATM
SCHEMBL5459233 0.70 POLB (0.59) KMT2ANPC1RAB9AMEN1ATM
SCHEMBL18902248 0.70 KCNH2 (0.76) KMT2ANPC1RAB9AMEN1ATM

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.