SCHEMBL2949358

SCHEMBL2949358

N#Cc1sc2c(ccc(=O)n2-c2cccnc2)c1N

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 1/20 0.37
KAT2B Q92831 1/20 0.37
ALDH1A1 P00352 4/20 0.37
MAPT P10636 2/20 0.37
MEN1 O00255 1/20 0.37
POLB P06746 1/20 0.37
KMT2A Q03164 1/20 0.37
MAT2A P31153 3/20 0.37
CYP11B1 P15538 1/20 0.37
CYP11B2 P19099 1/20 0.37
KDM4E B2RXH2 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ALOX12 P18054 1/20 0.35
MAPK1 P28482 1/20 0.35
PIK3CD O00329 5/20 0.34
PIK3R1 P27986 3/20 0.34
PIK3CA P42336 3/20 0.34
PIK3CB P42338 3/20 0.34
PIK3CG P48736 3/20 0.34
L3MBTL1 Q9Y468 2/20 0.33

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
SCHEMBL2960714 0.86 EP300 (0.37) EP300KAT2BALDH1A1MAPTMEN1
SCHEMBL2780092 0.85 ALDH1A1 (0.38) ALDH1A1MAPTMEN1POLBKMT2A
SCHEMBL2956492 0.80 CDK4 (0.38) EP300KAT2BALDH1A1MAPTMEN1
SCHEMBL2960372 0.78 ALDH1A1 (0.42) ALDH1A1MAPTMEN1POLBKMT2A
SCHEMBL1265636 0.73 ALDH1A1 (0.37) ALDH1A1MAPTMEN1POLBKMT2A
SCHEMBL2955709 0.73 ALDH1A1 (0.40) ALDH1A1MAPTMEN1POLBKMT2A
SCHEMBL2782388 0.71 CDK5 (0.39) EP300KAT2BALDH1A1MAPTMEN1
SCHEMBL2781979 0.69 ADORA1 (0.37) ALDH1A1MAPTMEN1POLBKMT2A
SCHEMBL5650413 0.69 ALDH1A1 (0.42) ALDH1A1MAPTMEN1POLBKMT2A
SCHEMBL2959253 0.68 KDM4E (0.38) ALDH1A1MAPTMEN1POLBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7763729-B2 Bicyclic heteroaromatic derivatives UCB PHARMA S.A. (BE) 2010-07-27 US disclosed
US-20090042877-A1 Bicyclic Heteroaromatic Derivatives CELLTECH R&D LIMITED (GB) 2009-02-12 US disclosed
US-7423047-B2 Arylamine substituted bicyclic heteroaromatic compounds as p38 kinase inhibitors CELLTECH R&D LIMITED (GB) 2008-09-09 US disclosed
US-20060004025-A1 Arylamine substututed bicyclic heteroaromatic compounds as p38 kinase inhibitors UCB PHARMA S.A. (BE) 2006-01-05 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 (2 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-20060004025-A1 Arylamine substututed bicyclic heteroaromatic compounds as p38 kinase inhibitors MAPK1, CNKSR1, ALK EP300 1168/4885KAT2B 1448/4885ALDH1A1 1045/4885
US-20090042877-A1 Bicyclic Heteroaromatic Derivatives MAPK1, CNKSR1, CBR1 EP300 1562/4885KAT2B 1309/4885ALDH1A1 717/4885

“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.