SCHEMBL3922264

SCHEMBL3922264

CCN(CC)C(=O)c1nn(-c2ccncc2)c(=O)c2c1c1ccccc1n2C

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.67
TP53 P04637 6/20 0.67
KDM4E B2RXH2 3/20 0.67
ALDH1A1 P00352 3/20 0.67
POLB P06746 3/20 0.67
GAA P10253 1/20 0.62
SMN1; SMN2 Q16637 4/20 0.57
TSHR P16473 4/20 0.56
KMT2A Q03164 3/20 0.56
HPGD P15428 2/20 0.56
MAPK1 P28482 1/20 0.56
RXFP1 Q9HBX9 3/20 0.54
HSD17B10 Q99714 3/20 0.53
ALOX15 P16050 1/20 0.52
NPSR1 Q6W5P4 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
SCHEMBL16135908 0.90 MAPT (0.69) MAPTTP53KDM4EALDH1A1POLB
SCHEMBL16136046 0.88 KDM4E (0.74) MAPTTP53KDM4EALDH1A1POLB
SCHEMBL16135907 0.86 KDM4E (0.74) MAPTTP53KDM4EALDH1A1POLB
SCHEMBL3920705 0.86 TSPO (0.54) MAPTTP53KDM4EALDH1A1POLB
SCHEMBL16135901 0.82 KDM4E (0.68) MAPTTP53KDM4EALDH1A1POLB
SCHEMBL16136098 0.81 KDM4E (0.62) MAPTTP53KDM4EALDH1A1POLB
SCHEMBL16136161 0.79 KDM4E (0.69) MAPTTP53KDM4EALDH1A1POLB
SCHEMBL20022622 0.79 KDM4E (0.61) MAPTTP53KDM4EALDH1A1POLB
SCHEMBL16311057 0.78 KDM4E (0.77) MAPTTP53KDM4EALDH1A1POLB
SCHEMBL16135893 0.78 KDM4E (0.67) MAPTTP53KDM4EALDH1A1POLB

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-7569567-B2 3-Heteroaryl-3,5-dihydro-4-oxo-4H-pyridazino[4,5-B]indole-1-carboxamide derivatives, their preparation and therapeutic use SANOFI-AVENTIS (FR) 2009-08-04 US claimed
US-20080249098-A1 3-Heteroaryl-3,5-dihydro-4-oxo-4H-pyridazino[4,5-B]indole-1-carboxamide Derivatives, Their Preparation and Therapeutic Use SANOFI-AVENTIS (FR) 2008-10-09 US claimed

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-20080249098-A1 3-Heteroaryl-3,5-dihydro-4-oxo-4H-pyridazino[4,5-B]indole-1-carboxamide Derivatives, Their Preparation and Therapeutic Use HTR3C, TPH1, IDO1 MAPT 3189/4885TP53 1779/4885KDM4E 2744/4885

“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.