SCHEMBL1231920

SCHEMBL1231920

CNC(=O)c1ccccc1Nc1cc(Nc2cccnc2)ncc1C(F)(F)F

nearest known ligand 0.72

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPK10 P53779 11/20 0.72
MAPK9 P45984 10/20 0.72
PTK2 Q05397 4/20 0.57
TYK2 P29597 4/20 0.55
JAK2 O60674 3/20 0.55
JAK1 P23458 3/20 0.55
MAPK3 P27361 2/20 0.50
MAPK1 P28482 2/20 0.50
MAPK8 P45983 1/20 0.48

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
SCHEMBL12887644 0.90 MAPK10 (0.69) MAPK10MAPK9PTK2TYK2JAK2
SCHEMBL1231716 0.85 MAPK9 (0.71) MAPK10MAPK9PTK2TYK2JAK2
SCHEMBL12102951 0.85 MAPK10 (0.74) MAPK10MAPK9PTK2TYK2JAK2
SCHEMBL1231866 0.85 MAPK9 (0.70) MAPK10MAPK9PTK2TYK2JAK2
SCHEMBL1231924 0.84 MAPK9 (0.75) MAPK10MAPK9PTK2TYK2JAK2
SCHEMBL1230844 0.83 MAPK10 (0.72) MAPK10MAPK9PTK2TYK2JAK2
SCHEMBL1231900 0.83 MAPK9 (0.66) MAPK10MAPK9PTK2TYK2JAK2
SCHEMBL1232438 0.83 MAPK9 (0.68) MAPK10MAPK9PTK2TYK2JAK2
Methylamine SCHEMBL28813226 0.82 MAPK10 (0.70) MAPK10MAPK9PTK2TYK2JAK2
SCHEMBL1230967 0.82 MAPK9 (0.71) MAPK10MAPK9PTK2TYK2JAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9580439-B2 Inhibitors of focal adhesion kinase THE SCRIPPS RESEARCH INSTITUTE (US) 2017-02-28 US disclosed
US-9580439-B2 Inhibitors of focal adhesion kinase THE SCRIPPS RESEARCH INSTITUTE (US) 2017-02-28 US disclosed
US-9580439-B2 Inhibitors of focal adhesion kinase THE SCRIPPS RESEARCH INSTITUTE (US) 2017-02-28 US disclosed
CN-103588704-B INHIBITORS OF FOCAL ADHESION KINASE 斯克里普斯研究学院 2016-09-14 CN disclosed
EP-2727909-A1 Inhibitors of focal adhesion kinase THE SCRIPPS RESEARCH INSTITUTE (US) 2014-05-07 EP disclosed
EP-2134689-B1 INHIBITORS OF FOCAL ADHESION KINASE SCRIPPS RESEARCH INST (US) 2014-04-23 EP disclosed
EP-2134689-B1 INHIBITORS OF FOCAL ADHESION KINASE SCRIPPS RESEARCH INST (US) 2014-04-23 EP disclosed
US-20130281443-A1 INHIBITORS OF FOCAL ADHESION KINASE THE SCRIPPS RESEARCH INSTITUTE (US) 2013-10-24 US disclosed
US-20130281443-A1 INHIBITORS OF FOCAL ADHESION KINASE THE SCRIPPS RESEARCH INSTITUTE (US) 2013-10-24 US disclosed
US-20130281443-A1 INHIBITORS OF FOCAL ADHESION KINASE THE SCRIPPS RESEARCH INSTITUTE (US) 2013-10-24 US disclosed
US-8501763-B2 Inhibitors of focal adhesion kinase THE SCRIPPS RESEARCH INSTITUTE (US) 2013-08-06 US disclosed
US-8501763-B2 Inhibitors of focal adhesion kinase THE SCRIPPS RESEARCH INSTITUTE (US) 2013-08-06 US disclosed
US-8501763-B2 Inhibitors of focal adhesion kinase THE SCRIPPS RESEARCH INSTITUTE (US) 2013-08-06 US disclosed
US-20110046121-A1 INHIBITORS OF FOCAL ADHESION KINASE THE SCRIPPS RESEARCH INSTITUTE (US) 2011-02-24 US disclosed
US-20110046121-A1 INHIBITORS OF FOCAL ADHESION KINASE THE SCRIPPS RESEARCH INSTITUTE (US) 2011-02-24 US disclosed
US-20110046121-A1 INHIBITORS OF FOCAL ADHESION KINASE THE SCRIPPS RESEARCH INSTITUTE (US) 2011-02-24 US disclosed
CN-101679264-A inhibitors of focal adhesion kinase SCRIPPS RESEARCH INST 2010-03-24 CN disclosed
WO-2008115369-A2 INHIBITORS OF FOCAL ADHESION KINASE THE SCRIPPS RESEARCH INSTITUTE (US) 2008-09-25 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-20110046121-A1 INHIBITORS OF FOCAL ADHESION KINASE PTK2, CABLES1, TNK2 MAPK10 590/4885MAPK9 239/4885PTK2 1/4885
US-20130281443-A1 INHIBITORS OF FOCAL ADHESION KINASE PTK2, CABLES1, TNK2 MAPK10 590/4885MAPK9 239/4885PTK2 1/4885

“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.