SCHEMBL5453655

SCHEMBL5453655

CN1CCc2c(sc(NC(=O)c3ccc(-c4ccc(Cl)cc4)o3)c2C(N)=O)C1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 9/20 0.66
PAX8 Q06710 2/20 0.66
ATM Q13315 1/20 0.59
MEN1 O00255 5/20 0.56
NPC1 O15118 2/20 0.54
RAB9A P51151 2/20 0.54
CASP6 P55212 1/20 0.54
MAPT P10636 3/20 0.53
ALOX15 P16050 2/20 0.53
TSHR P16473 2/20 0.53
HSD17B10 Q99714 1/20 0.53
KCNH2 Q12809 2/20 0.52
L3MBTL1 Q9Y468 1/20 0.51
GAA P10253 2/20 0.50
MAPKAPK2 P49137 1/20 0.50
FLT3 P36888 1/20 0.50
ALDH1A1 P00352 1/20 0.50
MAPK1 P28482 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
TDP1 Q9NUW8 1/20 0.50

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
SCHEMBL18902248 0.78 KCNH2 (0.76) KMT2AATMMEN1NPC1RAB9A
SCHEMBL5453561 0.76 KCNH2 (0.61) KMT2APAX8ATMMEN1NPC1
SCHEMBL5453554 0.76 KCNH2 (0.61) KMT2APAX8ATMMEN1NPC1
SCHEMBL5454292 0.74 KMT2A (0.76) KMT2APAX8ATMMEN1NPC1
SCHEMBL5465726 0.74 KMT2A (0.63) KMT2APAX8ATMMEN1NPC1
SCHEMBL16445880 0.73 KMT2A (0.68) KMT2APAX8ATMMEN1NPC1
SCHEMBL2140326 0.73 ATM (0.56) KMT2APAX8ATMMEN1NPC1
SCHEMBL5457288 0.73 ATM (0.61) KMT2AATMMEN1NPC1RAB9A
SCHEMBL5445203 0.72 ATM (0.59) KMT2APAX8ATMMEN1NPC1
SCHEMBL5453198 0.72 ATM (0.62) KMT2APAX8ATMMEN1NPC1

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 4785/4885PAX8 3016/4885ATM 2057/4885

“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.