SCHEMBL14740394

SCHEMBL14740394

C=CC(=O)Nc1cccc(-c2nc(Nc3ccc(N4CCOCC4)cc3)ncc2Nc2ccccc2)c1

nearest known ligand 0.80

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BTK Q06187 11/20 0.80
JAK2 O60674 5/20 0.70
JAK3 P52333 5/20 0.70
JAK1 P23458 4/20 0.70
TYK2 P29597 3/20 0.70
TTK P33981 1/20 0.62
EGFR P00533 3/20 0.62
FLT3 P36888 1/20 0.61
BLK P51451 1/20 0.61
FGFR2 P21802 1/20 0.58

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
SCHEMBL17071733 0.95 BTK (0.72) BTKJAK2JAK3JAK1TYK2
SCHEMBL17071576 0.95 BTK (0.78) BTKJAK2JAK3JAK1TYK2
SCHEMBL17071415 0.91 BTK (0.72) BTKJAK2JAK3JAK1TYK2
SCHEMBL17071525 0.91 BTK (0.73) BTKJAK2JAK3JAK1TYK2
SCHEMBL17071446 0.91 BTK (0.71) BTKJAK2JAK3JAK1TYK2
SCHEMBL17071416 0.91 BTK (0.79) BTKJAK2JAK3JAK1TYK2
SCHEMBL17071715 0.90 BTK (0.71) BTKJAK2JAK3JAK1TYK2
SCHEMBL17071752 0.90 BTK (0.72) BTKJAK2JAK3JAK1TYK2
SCHEMBL17071714 0.90 BTK (0.71) BTKJAK2JAK3JAK1TYK2
SCHEMBL12813134 0.89 BTK (1.00) BTKJAK2JAK3JAK1TYK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160046586-A1 SUBSTITUTED N-(3-(PYRIMIDIN-4-YL)PHENYL)ACRYLAMIDE ANALOGS AS TYROSINE RECEPTOR KINASE BTK INHIBITORS UNIV UTAH RES FOUND (US) 2016-02-18 US disclosed
US-20160046586-A1 SUBSTITUTED N-(3-(PYRIMIDIN-4-YL)PHENYL)ACRYLAMIDE ANALOGS AS TYROSINE RECEPTOR KINASE BTK INHIBITORS UNIV UTAH RES FOUND (US) 2016-02-18 US disclosed
US-9206176-B2 Substituted N-(3-(pyrimidin-4-yl)phenyl)acrylamide analogs as tyrosine receptor kinase BTK inhibitors UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2015-12-08 US disclosed
US-9206176-B2 Substituted N-(3-(pyrimidin-4-yl)phenyl)acrylamide analogs as tyrosine receptor kinase BTK inhibitors UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2015-12-08 US disclosed
US-8703767-B2 Substituted N-(3-(pyrimidin-4-yl)phenyl)acrylamide analogs as tyrosine receptor kinase BTK inhibitors UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2014-04-22 US disclosed
US-20130059847-A1 SUBSTITUTED N-(3-(PYRIMIDIN-4-YL)PHENYL)ACRYLAMIDE ANALOGS AS TYROSINE RECEPTOR KINASE BTK INHIBITORS UNIVERSITY OF UTAH 2013-03-07 US disclosed
US-20130059847-A1 SUBSTITUTED N-(3-(PYRIMIDIN-4-YL)PHENYL)ACRYLAMIDE ANALOGS AS TYROSINE RECEPTOR KINASE BTK INHIBITORS UNIVERSITY OF UTAH 2013-03-07 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-20160046586-A1 SUBSTITUTED N-(3-(PYRIMIDIN-4-YL)PHENYL)ACRYLAMIDE ANALOGS AS TYROSINE RECEPTOR KINASE BTK INHIBITORS BTK, SYK, LYN BTK 1/4885JAK2 20/4885JAK3 58/4885
US-20130059847-A1 SUBSTITUTED N-(3-(PYRIMIDIN-4-YL)PHENYL)ACRYLAMIDE ANALOGS AS TYROSINE RECEPTOR KINASE BTK INHIBITORS BTK, SYK, LYN BTK 1/4885JAK2 20/4885JAK3 58/4885

“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.