SCHEMBL2952952

SCHEMBL2952952

Cc1cc(Nc2c(C#N)sc3c2ccc(=O)n3-c2ccccc2Cl)ccc1F

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.35
MAPK13 O15264 1/20 0.35
MAPK12 P53778 1/20 0.35
MAPK11 Q15759 1/20 0.35
MAPK14 Q16539 1/20 0.35
EGFR P00533 3/20 0.34
LMNA P02545 1/20 0.34
PDGFRB P09619 1/20 0.34
FGFR1 P11362 1/20 0.34
SRC P12931 1/20 0.34
PDGFRA P16234 1/20 0.34
STAT5A P42229 1/20 0.34
ACVR1 Q04771 1/20 0.34
PKMYT1 Q99640 1/20 0.34
RAPGEF4 Q8WZA2 1/20 0.33
MAP3K8 P41279 9/20 0.33
ERBB2 P04626 2/20 0.33
ABL1 P00519 1/20 0.33
GAA P10253 1/20 0.32
GFER P55789 1/20 0.32

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
SCHEMBL2950115 0.92 LMNA (0.35) CHRNA7LMNARAPGEF4GAAGFER
SCHEMBL2954154 0.87 LMNA (0.36) CHRNA7LMNARAPGEF4MAP3K8GAA
SCHEMBL2961083 0.86 MAPT (0.39) CHRNA7GAAIDO1
SCHEMBL2958665 0.84 WEE1 (0.35) MAPK13MAPK12MAPK11MAPK14GAA
SCHEMBL2960348 0.83 LMNA (0.36) LMNARAPGEF4GAAGFERIDO1
SCHEMBL2955910 0.83 CHRNA7 (0.44) CHRNA7MAPK13MAPK12MAPK11MAPK14
SCHEMBL2950043 0.81 MAP3K8 (0.41) EGFRMAP3K8ERBB2IDO1
SCHEMBL2952051 0.78 IDO1 (0.38) CHRNA7GAAIDO1
SCHEMBL2952695 0.77 LMNA (0.36) MAPK14LMNARAPGEF4GAAGFER
SCHEMBL2959772 0.77 ALDH1A1 (0.38) MAPK13MAPK12MAPK11MAPK14LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7423047-B2 Arylamine substituted bicyclic heteroaromatic compounds as p38 kinase inhibitors CELLTECH R&D LIMITED (GB) 2008-09-09 US claimed
US-20060004025-A1 Arylamine substututed bicyclic heteroaromatic compounds as p38 kinase inhibitors UCB PHARMA S.A. (BE) 2006-01-05 US claimed
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-7482452-B2 Process for preparing 3-aminothienopyridone derivatives CELLTECH R&D LIMITED (GB) 2009-01-27 US disclosed
EP-1638980-B1 PROCESS FOR PREPARING 3-AMINOTHIENOPYRIDONE DERIVATIVES UCB PHARMA SA (BE) 2008-11-05 EP disclosed
US-7423047-B2 Arylamine substituted bicyclic heteroaromatic compounds as p38 kinase inhibitors CELLTECH R&D LIMITED (GB) 2008-09-09 US disclosed
US-20070191608-A1 Process for preparing 3-aminothienopyridone derivatives CELLTECH R&D LIMITED (GB) 2007-08-16 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 (3 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-20070191608-A1 Process for preparing 3-aminothienopyridone derivatives MAPK3, MAP3K6, MAP4K1 CHRNA7 2160/4885MAPK13 35/4885MAPK12 36/4885
US-20060004025-A1 Arylamine substututed bicyclic heteroaromatic compounds as p38 kinase inhibitors MAPK1, CNKSR1, ALK CHRNA7 1817/4885MAPK13 26/4885MAPK12 54/4885
US-20090042877-A1 Bicyclic Heteroaromatic Derivatives MAPK1, CNKSR1, CBR1 CHRNA7 2079/4885MAPK13 44/4885MAPK12 106/4885

“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.