SCHEMBL4842002

SCHEMBL4842002

CN(C)C(=O)Cc1nn(-c2ccccn2)c(=O)c2c1c1ccc(F)cc1n2C

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSPO P30536 1/20 0.62
SMN1; SMN2 Q16637 1/20 0.38
POLB P06746 1/20 0.38
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
FFAR4 Q5NUL3 1/20 0.36

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
SCHEMBL4841448 0.89 TSPO (0.78) TSPO
SCHEMBL5746627 0.85 TSPO (0.66) TSPOSMN1; SMN2POLB
SCHEMBL3920169 0.84 TP53 (0.45) TSPOSMN1; SMN2POLBKDM4EALDH1A1
Hydrochloric Acid SCHEMBL4843306 0.84 TSPO (0.65) TSPOSMN1; SMN2POLB
SCHEMBL5744887 0.83 TSPO (0.66) TSPOSMN1; SMN2POLB
Hydrochloric Acid SCHEMBL4842016 0.82 TSPO (0.65) TSPOSMN1; SMN2POLB
SCHEMBL5786270 0.81 POLB (0.44) TSPOSMN1; SMN2POLBKDM4EALDH1A1
SCHEMBL3932062 0.80 ALDH1A1 (0.46) SMN1; SMN2POLBKDM4EALDH1A1
SCHEMBL17959431 0.79 TSPO (0.73) TSPO
SCHEMBL17974080 0.79 TSPO (0.73) TSPO

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080255129-A1 3-Heteroaryl-3,5-dihydro-4-oxo-4H-pyridazino[4,5-b]indole-1-acetamide derivatives, their preparation and their application in therapeutics SANOFI-AVENTIS (FR) 2008-10-16 US disclosed
US-7405306-B2 3-Heteroaryl-3,5-dihydro-4-oxo-4H-pyridazino[4,5-b]indole-1-acetamide derivatives, their preparation and their application in therapeutics SANOFI-AVENTIS (FR) 2008-07-29 US disclosed
US-20080076775-A1 3-Heteroaryl-3,5-dihydro-4-oxo-4H-pyridazino[4,5-b]indole-1-acetamide derivatives, their preparation and their application in therapeutics SANOFI-AVENTIS (FR) 2008-03-27 US disclosed
US-7323467-B2 3-heteroaryl-3,5-dihydro-4-oxo-4H-pyridazino[4,5-b]indole-1-acetamide derivatives, their preparation and their application in therapeutics SANOFI-AVENTIS (FR) 2008-01-29 US disclosed
US-20070219202-A1 3-Heteroaryl-3,5-dihydro-4-oxo-4H-pyridazino[4,5 b]indole-1-acetamide derivatives, their preparation and their application in therapeutics SANOFI-AVENTIS (FR) 2007-09-20 US disclosed
US-7235554-B2 3-heteroaryl-3,5-dihydro-4-oxo-4H-pyridazino[4,5-b] indole-1-acetamide derivatives, preparation and use thereof in medicaments SANOFI-AVENTIS (FR) 2007-06-26 US disclosed
EP-1492792-B1 3-HETEROARYL-3,5-DIHYDRO-4-OXO-4H-PYRIDAZINO¬4,5-B|INDOLE-1-ACETAMIDE DERIVATIVES, PREPARATION AND USE THEREOF IN MEDICAMENTS SANOFI AVENTIS (FR) 2006-03-29 EP disclosed
US-20050124615-A1 3-heteroarly-3,5-dihydro-4-oxo-4h-pyridazino[4,5-b] indole-1-acetamide derivatives, preparation and use thereof in medicaments SANOFI (FR) 2005-06-09 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 (4 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-20080076775-A1 3-Heteroaryl-3,5-dihydro-4-oxo-4H-pyridazino[4,5-b]indole-1-acetamide derivatives, their preparation and their application in therapeutics IDO1, IDO2, TPH1 TSPO 1596/4885SMN1; SMN2 3299/4885POLB 4577/4885
US-20050124615-A1 3-heteroarly-3,5-dihydro-4-oxo-4h-pyridazino[4,5-b] indole-1-acetamide derivatives, preparation and use thereof in medicaments HRH4, IDO1, HTR4 TSPO 3871/4885SMN1; SMN2 4852/4885POLB 2420/4885
US-20070219202-A1 3-Heteroaryl-3,5-dihydro-4-oxo-4H-pyridazino[4,5 b]indole-1-acetamide derivatives, their preparation and their application in therapeutics IDO1, IDO2, TPH1 TSPO 1814/4885SMN1; SMN2 3163/4885POLB 4568/4885
US-20080255129-A1 3-Heteroaryl-3,5-dihydro-4-oxo-4H-pyridazino[4,5-b]indole-1-acetamide derivatives, their preparation and their application in therapeutics IDO1, IDO2, TPH1 TSPO 1596/4885SMN1; SMN2 3299/4885POLB 4577/4885

“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.