SCHEMBL1964522

SCHEMBL1964522

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

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.41
MEN1 O00255 6/20 0.41
KMT2A Q03164 6/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
CRHBP P24387 2/20 0.41
HTT P42858 2/20 0.41
CRHR2 Q13324 2/20 0.41
HPGD P15428 1/20 0.41
POLB P06746 1/20 0.40
ALDH1A1 P00352 2/20 0.39
GAA P10253 2/20 0.39
ALOX12 P18054 3/20 0.37
THRB P10828 2/20 0.37
LMNA P02545 2/20 0.37
GFER P55789 1/20 0.37
PTK2B Q14289 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
RAB9A P51151 2/20 0.36
GLA P06280 1/20 0.36
MAPK1 P28482 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
SCHEMBL1964519 1.00 MAPT (0.41) MAPTMEN1KMT2ASMN1; SMN2CRHBP
SCHEMBL1960748 0.93 CYP1A2 (0.43) MAPTMEN1KMT2ASMN1; SMN2CRHBP
SCHEMBL1960749 0.93 CYP1A2 (0.43) MAPTMEN1KMT2ASMN1; SMN2CRHBP
SCHEMBL1963715 0.90 MAPT (0.43) MAPTMEN1KMT2ASMN1; SMN2CRHBP
SCHEMBL1963716 0.90 MAPT (0.43) MAPTMEN1KMT2ASMN1; SMN2CRHBP
SCHEMBL9833537 0.85 MAPT (0.41) MAPTMEN1KMT2ASMN1; SMN2CRHBP
SCHEMBL11918052 0.85 MAPT (0.41) MAPTMEN1KMT2ASMN1; SMN2CRHBP
SCHEMBL9834086 0.85 MAPT (0.60) MAPTMEN1KMT2ASMN1; SMN2CRHBP
SCHEMBL9834091 0.85 MAPT (0.60) MAPTMEN1KMT2ASMN1; SMN2CRHBP
SCHEMBL1962297 0.85 MEN1 (0.49) MAPTMEN1KMT2ASMN1; SMN2CRHBP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1966158-B1 SUBSTITUTED CINNOLINE DERIVATIVES AS GABAA-RECEPTOR MODULATORS AND METHOD FOR THEIR SYNTHESIS ASTRAZENECA AB (SE) 2012-08-08 EP disclosed
US-20110144331-A1 Cinnoline Compounds for the Treatment of Anxiety, Cognitive and Mood Disorders ASTRAZENECA AB (SE) 2011-06-16 US disclosed
WO-2010123441-A1 CRYSTALLINE FORM OF 4-AMINO-8-(2-FLUORO-6-METHOXY-PHENYL)-N-PROPYLCINNOLINE-3- CARBOXAMIDE HYDROGEN SULPHATE, FOR TREATMENT OF ANXIETY DISORDERS ASTRAZENECA AB (SE) 2010-10-28 WO disclosed
US-20100184738-A1 Uses of cinnoline compounds to treat schizophrenia ASTRAZENECA AB (SE) 2010-07-22 US 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
US-7465795-B2 Compounds and uses thereof ASTRAZENECA AB (SE) 2008-12-16 US 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 MAPT 1/4885MEN1 890/4885KMT2A 1551/4885
US-20070142382-A1 Compounds and Uses Thereof MAPT, BDNF, PYGB MAPT 1/4885MEN1 890/4885KMT2A 1551/4885
US-20110144331-A1 Cinnoline Compounds for the Treatment of Anxiety, Cognitive and Mood Disorders HTR7, HTR2C, CRH MAPT 6/4885MEN1 92/4885KMT2A 1653/4885
US-20090018112-A1 Compounds and Uses Thereof MAPT, BDNF, PYGB MAPT 1/4885MEN1 890/4885KMT2A 1551/4885
US-20090036454-A1 Compounds and Uses Thereof MAPT, BDNF, PYGB MAPT 1/4885MEN1 890/4885KMT2A 1551/4885
US-20100184738-A1 Uses of cinnoline compounds to treat schizophrenia COMT, BACE1, CHAT MAPT 21/4885MEN1 720/4885KMT2A 3370/4885
US-20080318925-A1 Compounds and Uses Thereof - 849 COMT, UGT1A9, BACE1 MAPT 4/4885MEN1 3378/4885KMT2A 2812/4885

“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.