SCHEMBL1960422

SCHEMBL1960422

CCOC(=O)C(C#N)=NNc1ccccc1Br

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.58
KMT2A Q03164 7/20 0.58
THRB P10828 2/20 0.58
GAA P10253 6/20 0.54
ALDH1A1 P00352 3/20 0.54
KDM4E B2RXH2 2/20 0.54
SMN1; SMN2 Q16637 4/20 0.47
MAPT P10636 4/20 0.47
LMNA P02545 3/20 0.47
MAPK1 P28482 2/20 0.47
HPGD P15428 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44
ALOX12 P18054 3/20 0.43
CRHBP P24387 2/20 0.42
HTT P42858 2/20 0.42
CRHR2 Q13324 2/20 0.42
DHODH Q02127 1/20 0.42

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
SCHEMBL1960421 1.00 MEN1 (0.58) MEN1KMT2ATHRBGAAALDH1A1
SCHEMBL216543 0.81 GAA (0.47) MEN1KMT2AGAAALDH1A1SMN1; SMN2
SCHEMBL1963715 0.81 MAPT (0.43) MEN1KMT2ATHRBGAAALDH1A1
SCHEMBL1963716 0.81 MAPT (0.43) MEN1KMT2ATHRBGAAALDH1A1
SCHEMBL1963333 0.79 MAPT (0.46) MEN1KMT2ATHRBGAAALDH1A1
SCHEMBL1963334 0.79 MAPT (0.46) MEN1KMT2ATHRBGAAALDH1A1
SCHEMBL1964522 0.79 MAPT (0.41) MEN1KMT2ATHRBGAAALDH1A1
SCHEMBL1964519 0.79 MAPT (0.41) MEN1KMT2ATHRBGAAALDH1A1
SCHEMBL6816339 0.78 MAPT (0.49) MEN1KMT2AGAAALDH1A1KDM4E
SCHEMBL6816346 0.78 MAPT (0.49) MEN1KMT2AGAAALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110144331-A1 Cinnoline Compounds for the Treatment of Anxiety, Cognitive and Mood Disorders ASTRAZENECA AB (SE) 2011-06-16 US disclosed
US-20100184738-A1 Uses of cinnoline compounds to treat schizophrenia ASTRAZENECA AB (SE) 2010-07-22 US disclosed
EP-2167091-A1 CINNOLINE COMPOUNDS FOR USE IN THE TREATMENT OF SCHIZOPHRENIA AstraZeneca AB (SE) 2010-03-31 EP disclosed
US-20090036454-A1 Compounds and Uses Thereof ASTRAZENECA AB (SE) 2009-02-05 US disclosed
US-20090018112-A1 Compounds and Uses Thereof ASTRAZENECA AB (SE) 2009-01-15 US disclosed
US-20080318925-A1 Compounds and Uses Thereof - 849 ASTRAZENECA AB (SE) 2008-12-25 US disclosed
WO-2008155573-A1 CINNOLINE COMPOUNDS FOR USE IN THE TREATMENT OF SCHIZOPHRENIA ASTRAZENECA AB (SE) 2008-12-24 WO disclosed
US-7465795-B2 Compounds and uses thereof ASTRAZENECA AB (SE) 2008-12-16 US disclosed
US-7425556-B2 Compounds and uses thereof ASTRAZENECA AB (SE) 2008-09-16 US disclosed
EP-1966158-A1 SUBSTITUTED CINNOLINE DERIVATIVES AS GABAA-RECEPTOR MODULATORS AND METHOD FOR THEIR SYNTHESIS AstraZeneca AB (SE) 2008-09-10 EP disclosed
WO-2007073283-A1 SUBSTITUTED CINNOLINE DERIVATIVES AS GABAA-RECEPTOR MODULATORS AND METHOD FOR THEIR SYNTHESIS ASTRAZENECA AB (SE) 2007-06-28 WO disclosed
US-20070142328-A1 Compounds and Uses Thereof ASTRAZENECA AB (SE) 2007-06-21 US disclosed
US-20070142382-A1 Compounds and Uses Thereof ASTRAZENECA AB (SE) 2007-06-21 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 (7 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-20070142328-A1 Compounds and Uses Thereof MAPT, BDNF, PYGB MEN1 890/4885KMT2A 1551/4885THRB 969/4885
US-20070142382-A1 Compounds and Uses Thereof MAPT, BDNF, PYGB MEN1 890/4885KMT2A 1551/4885THRB 969/4885
US-20110144331-A1 Cinnoline Compounds for the Treatment of Anxiety, Cognitive and Mood Disorders HTR7, HTR2C, CRH MEN1 92/4885KMT2A 1653/4885THRB 1007/4885
US-20090018112-A1 Compounds and Uses Thereof MAPT, BDNF, PYGB MEN1 890/4885KMT2A 1551/4885THRB 969/4885
US-20090036454-A1 Compounds and Uses Thereof MAPT, BDNF, PYGB MEN1 890/4885KMT2A 1551/4885THRB 969/4885
US-20100184738-A1 Uses of cinnoline compounds to treat schizophrenia COMT, BACE1, CHAT MEN1 720/4885KMT2A 3370/4885THRB 920/4885
US-20080318925-A1 Compounds and Uses Thereof - 849 COMT, UGT1A9, BACE1 MEN1 3378/4885KMT2A 2812/4885THRB 487/4885

“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.