SCHEMBL2442970

SCHEMBL2442970

CC(C)Cn1ncc2cc(/C(=N\OCCNC(=O)OC(C)(C)C)c3ccc(F)cc3F)ccc21

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.44
SCN9A Q15858 1/20 0.39
HTR2A P28223 2/20 0.38
HTR2C P28335 2/20 0.38
PLK1 P53350 3/20 0.35
HDAC2 Q92769 3/20 0.34
HDAC1 Q13547 1/20 0.34
BRD4 O60885 2/20 0.34
NTRK1 P04629 1/20 0.34
EPHX2 P34913 2/20 0.33
PPARG P37231 2/20 0.33
NR3C1 P04150 1/20 0.33
HDAC3 O15379 1/20 0.33
KDM4C Q9H3R0 1/20 0.33
BUB1 O43683 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
SCHEMBL2442973 1.00 MAPK14 (0.44) MAPK14SCN9AHTR2AHTR2CPLK1
SCHEMBL2443949 0.91 MAPK14 (0.40) MAPK14SCN9AHTR2AHTR2CPLK1
SCHEMBL2443954 0.91 MAPK14 (0.40) MAPK14SCN9AHTR2AHTR2CPLK1
SCHEMBL2443370 0.84 HTR2A (0.47) MAPK14HTR2AHTR2CHDAC2HDAC1
SCHEMBL14312206 0.84 HTR2A (0.47) MAPK14HTR2AHTR2CHDAC2HDAC1
SCHEMBL2452000 0.82 HTR2A (0.47) MAPK14HTR2AHTR2CHDAC2HDAC1
SCHEMBL14312363 0.82 HTR2A (0.47) MAPK14HTR2AHTR2CHDAC2HDAC1
SCHEMBL15135411 0.81 MAPK14 (0.42) MAPK14HTR2AHTR2CHDAC2HDAC1
SCHEMBL15135412 0.81 MAPK14 (0.42) MAPK14HTR2AHTR2CHDAC2HDAC1
SCHEMBL2450214 0.78 HTR2A (0.43) MAPK14HTR2AHTR2CHDAC2HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8518983-B2 P38 inhibitors and methods of use thereof ARRAY BIOPHARMA INC. (US) 2013-08-27 US claimed
EP-2039685-B1 Heterobicyclic compounds as P38 inhibitors ARRAY BIOPHARMA INC (US) 2012-12-26 EP claimed
US-8518983-B2 P38 inhibitors and methods of use thereof ARRAY BIOPHARMA INC. (US) 2013-08-27 US disclosed
EP-1997810-B1 Indazoles, benzotriazoles and N-analogs thereof as p38 kinase inhibitors ARRAY BIOPHARMA INC (US) 2013-07-31 EP disclosed
EP-2039685-B1 Heterobicyclic compounds as P38 inhibitors ARRAY BIOPHARMA INC (US) 2012-12-26 EP disclosed
US-8017641-B2 P38 inhibitors and methods of use thereof ARRAY BIOPHARMA INC. (US) 2011-09-13 US disclosed
US-7799782-B2 P38 inhibitors and methods of use thereof ARRAY BIOPHARMA INC. (US) 2010-09-21 US disclosed
US-20090149459-A1 P38 INHIBITORS AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC. (US) 2009-06-11 US disclosed
US-20090143422-A1 P38 INHIBITORS AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC. (US) 2009-06-04 US disclosed
US-20090136596-A1 P38 INHIBITORS AND METHODS OF USE THEREOF ARRAY BIOPHARMA INC. (US) 2009-05-28 US disclosed
US-7521447-B2 P38 inhibitors and methods of use thereof ARRAY BIOPHARMA INC. (US) 2009-04-21 US disclosed
EP-2039685-A2 Heterobicyclic compounds as P38 inhibitors Array Biopharma, Inc. (US) 2009-03-25 EP disclosed
EP-1997810-A2 Indazole, benzoxazole and pyrazolopyridine derivatives for medical use Array Biopharma Inc. (US) 2008-12-03 EP disclosed
EP-1997809-A2 Indazole, benzoxazole and pyrazolopyridine derivatives for medical use Array Biopharma Inc. (US) 2008-12-03 EP disclosed
EP-1997811-A2 Indazole, benzoxazole and pyrazolopyridine derivatives as P38 kinase inhibitors Array Biopharma Inc. (US) 2008-12-03 EP disclosed
US-7135575-B2 P38 inhibitors and methods of use thereof ARRAY BIOPHARMA, INC. (US) 2006-11-14 US disclosed
US-20040192653-A1 P38 inhibitors and methods of use thereof ARRAY BIOPHARMA INC. 2004-09-30 US disclosed
US-20040180896-A1 P38 inhibitors and methods of use thereof ARRAY BIOPHARMA, INC. 2004-09-16 US disclosed
US-20040176325-A1 P38 MAP kinase inhibitors comprising indazole derivatives; antiinflammatory and antiproliferative agents; autoimmune, bone, and neurodegenerative disorders; viricides, infections ARRAY BIOPHARMA INC. 2004-09-09 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 (6 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-20090143422-A1 P38 INHIBITORS AND METHODS OF USE THEREOF MAPKAPK2, MAPK1, MAPK8 MAPK14 37/4885SCN9A 4689/4885HTR2A 3533/4885
US-20040176325-A1 P38 MAP kinase inhibitors comprising indazole derivatives; antiinflammatory and antiproliferative agents; autoimmune, bone, and neurodegenerative disorders; viricides, infections MAPK1, MAPK3, MAP3K1 MAPK14 29/4885SCN9A 4084/4885HTR2A 4514/4885
US-20090136596-A1 P38 INHIBITORS AND METHODS OF USE THEREOF MAPKAPK2, MAPK1, MAPK8 MAPK14 37/4885SCN9A 4689/4885HTR2A 3533/4885
US-20090149459-A1 P38 INHIBITORS AND METHODS OF USE THEREOF MAPKAPK2, MAPK1, MAPK8 MAPK14 37/4885SCN9A 4689/4885HTR2A 3533/4885
US-20040180896-A1 P38 inhibitors and methods of use thereof MAPK1, MAPK3, MAPK8 MAPK14 39/4885SCN9A 4678/4885HTR2A 3462/4885
US-20040192653-A1 P38 inhibitors and methods of use thereof MAPK1, MAPK3, MAPK8 MAPK14 39/4885SCN9A 4678/4885HTR2A 3462/4885

“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.