SCHEMBL17071709

SCHEMBL17071709

C=CC(=O)Nc1cccc(-c2nc(Nc3cccc(N4CCOCC4)c3)ncc2F)c1

nearest known ligand 0.72

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BTK Q06187 11/20 0.72
JAK3 P52333 3/20 0.63
JAK2 O60674 3/20 0.63
JAK1 P23458 2/20 0.63
TYK2 P29597 1/20 0.63
EGFR P00533 5/20 0.61
FLT3 P36888 1/20 0.59
BLK P51451 1/20 0.59
CCNT1 O60563 1/20 0.58
CCNE1 P24864 1/20 0.58
CDK2 P24941 1/20 0.58
CDK9 P50750 1/20 0.58
ITK Q08881 1/20 0.56
TTK P33981 1/20 0.56

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
SCHEMBL19645733 0.93 BTK (0.62) BTKJAK3JAK2JAK1TYK2
SCHEMBL17071727 0.91 BTK (0.65) BTKJAK3JAK2JAK1TYK2
SCHEMBL17071317 0.91 BTK (0.60) BTKJAK3JAK2JAK1TYK2
SCHEMBL17071716 0.90 BTK (0.76) BTKJAK3JAK2JAK1TYK2
SCHEMBL17071697 0.90 BTK (0.63) BTKJAK3JAK2JAK1TYK2
SCHEMBL17071757 0.90 BTK (0.71) BTKJAK3JAK2EGFRFLT3
SCHEMBL22213255 0.90 EGFR (0.63) BTKJAK3JAK2JAK1TYK2
SCHEMBL15640174 0.90 BTK (0.89) BTKJAK3JAK2JAK1TYK2
SCHEMBL17071717 0.90 BTK (0.67) BTKJAK3JAK2JAK1TYK2
SCHEMBL17071483 0.89 BTK (0.69) BTKJAK3JAK2JAK1TYK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3680238-A1 SUBSTITUTED N-(3-(PYRIMIDIN-4-YL)PHENYL)ACRYLAMIDE ANALOGS AS TYROSINE RECEPTOR KINASE BTK INHIBITORS University of Utah Research Foundation (US) 2020-07-15 EP disclosed
US-20180134719-A1 SUBSTITUTED N-(3-(PYRIMIDIN-4-YL)PHENYL)ACRYLAMIDE ANALOGS AS TYROSINE RECEPTOR KINASE BTK INHIBITORS UNIVERSITY OF UTAH RESEARCH FOUNDATION 2018-05-17 US disclosed
US-9828376-B2 Substituted N-(3-pyrimidin-4-yl)phenyl)acrylamide analogs as tyrosine receptor kinase BTK inhibitors UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2017-11-28 US disclosed
US-20150252048-A1 SUBSTITUTED N-(3-PYRIMIDIN-4-YL)PHENYL)ACRYLAMIDE ANALOGS AS TYROSINE RECEPTOR KINASE BTK INHIBITORS UNIVERSITY OF UTAH 2015-09-10 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-20150252048-A1 SUBSTITUTED N-(3-PYRIMIDIN-4-YL)PHENYL)ACRYLAMIDE ANALOGS AS TYROSINE RECEPTOR KINASE BTK INHIBITORS BTK, SYK, LYN BTK 1/4885JAK3 41/4885JAK2 13/4885
US-20180134719-A1 SUBSTITUTED N-(3-(PYRIMIDIN-4-YL)PHENYL)ACRYLAMIDE ANALOGS AS TYROSINE RECEPTOR KINASE BTK INHIBITORS BTK, SYK, LYN BTK 1/4885JAK3 58/4885JAK2 20/4885

“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.