SCHEMBL4347807

SCHEMBL4347807

OCC#CCc1nc(-c2ccc(F)cc2)c(-c2ccncc2)n1CCCc1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 19/20 0.68
MAPK11 Q15759 7/20 0.43
MAP4K4 O95819 2/20 0.43
MAPK13 O15264 6/20 0.42
MAPK12 P53778 6/20 0.42
GCGR P47871 1/20 0.42
MAPK10 P53779 1/20 0.42
MAPK9 P45984 1/20 0.41
CSNK1A1 P48729 1/20 0.41
CSNK1D P48730 1/20 0.41
CDC42BPA Q5VT25 1/20 0.41
AURKB Q96GD4 1/20 0.41
MAP4K5 Q9Y4K4 1/20 0.41

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
SCHEMBL1127850 0.90 MAPK14 (0.62) MAPK14MAPK11MAP4K4MAPK13MAPK12
SCHEMBL5998468 0.88 MAPK14 (0.60) MAPK14MAPK11MAPK13MAPK12GCGR
SCHEMBL13670475 0.87 MAPK14 (0.71) MAPK14MAPK11MAP4K4MAPK13MAPK12
SCHEMBL5820266 0.86 MAPK14 (0.85) MAPK14MAPK11MAP4K4MAPK13MAPK12
SCHEMBL7144420 0.86 MAPK14 (0.58) MAPK14MAPK11MAPK13MAPK12GCGR
SCHEMBL5997826 0.85 MAPK14 (0.57) MAPK14MAPK11MAPK13MAPK12GCGR
SCHEMBL5903491 0.85 MAPK14 (0.68) MAPK14MAPK11MAP4K4MAPK13MAPK12
SCHEMBL7162537 0.84 MAPK14 (0.67) MAPK14MAPK11MAP4K4MAPK13MAPK12
SCHEMBL7139249 0.81 MAPK14 (0.66) MAPK14MAPK11MAP4K4MAPK13MAPK12
SCHEMBL12856400 0.81 MAPK14 (1.00) MAPK14MAPK11MAP4K4MAPK13MAPK12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140080210-A1 Treatment of Pluripotent Cells JANSSEN BIOTECH, INC. (US) 2014-03-20 US claimed
US-20130337564-A1 Treatment of Pluripotent Cells JANSSEN BIOTECH, INC. 2013-12-19 US claimed
US-20090325293-A1 TREATMENT OF PLURIPOTENT CELLS JANSSEN BIOTECH, INC. 2009-12-31 US claimed
EP-1028954-B1 SUBSTITUTED IMIDAZOLES USEFUL IN THE TREATMENT OF INFLAMMATORY DISEASES ORTHO MCNEIL PHARM INC (US) 2003-07-02 EP claimed
EP-1028954-A1 SUBSTITUTED IMIDAZOLES USEFUL IN THE TREATMENT OF INFLAMMATORY DISEASES Ortho-McNeil Pharmaceutical, Inc. (US) 2000-08-23 EP claimed
US-5965583-A ANTIINFLAMMATORY AGENTS IN THE TREATMENT OF DISEASES ASSOCIATED WITH OVERPRODUCTION OF INFLAMMATORY CYTOKINES ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 1999-10-12 US claimed
WO-1998047892-A1 SUBSTITUTED IMIDAZOLES USEFUL IN THE TREATMENT OF INFLAMMATORY DISEASES ORTHO-MCNEIL CORPORATION, INC. (US) 1998-10-29 WO claimed
US-20180127723-A1 TREATMENT OF PLURIPOTENT CELLS JANSSEN BIOTECH, INC. (US) 2018-05-10 US disclosed
EP-2664669-B1 TREATMENT OF PLURIPOTENT CELLS JANSSEN BIOTECH INC (US) 2017-12-27 EP disclosed
EP-2664669-A1 Treatment of pluripotent cells Janssen Biotech, Inc. (US) 2013-11-20 EP disclosed
US-20060241150-A1 P38 kinase inhibitor compositions and methods of using the same THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA 2006-10-26 US disclosed
EP-1631145-A2 P38 KINASE INHIBITOR COMPOSITIONS AND METHODS OF USING THE SAME The Trustees of The University of Pennsylvania (US) 2006-03-08 EP disclosed
WO-2005000405-A2 P38 KINASE INHIBITOR COMPOSITIONS AND METHODS OF USE THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2005-01-06 WO disclosed
EP-1028954-B1 SUBSTITUTED IMIDAZOLES USEFUL IN THE TREATMENT OF INFLAMMATORY DISEASES ORTHO MCNEIL PHARM INC (US) 2003-07-02 EP disclosed
EP-1028954-A1 SUBSTITUTED IMIDAZOLES USEFUL IN THE TREATMENT OF INFLAMMATORY DISEASES Ortho-McNeil Pharmaceutical, Inc. (US) 2000-08-23 EP disclosed
US-5965583-A ANTIINFLAMMATORY AGENTS IN THE TREATMENT OF DISEASES ASSOCIATED WITH OVERPRODUCTION OF INFLAMMATORY CYTOKINES ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 1999-10-12 US disclosed
WO-1998047892-A1 SUBSTITUTED IMIDAZOLES USEFUL IN THE TREATMENT OF INFLAMMATORY DISEASES ORTHO-MCNEIL CORPORATION, INC. (US) 1998-10-29 WO 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-20060241150-A1 P38 kinase inhibitor compositions and methods of using the same MAPK7, MAPK1, MAP3K7 MAPK14 19/4885MAPK11 54/4885MAP4K4 66/4885
US-20180127723-A1 TREATMENT OF PLURIPOTENT CELLS GSK3B, GSK3A, GSKIP MAPK14 2384/4885MAPK11 3117/4885MAP4K4 915/4885

“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.