SCHEMBL17071642

SCHEMBL17071642

C=CC(=O)Nc1cccc(-c2nc(Nc3cccc(N4CCN(CCO)CC4)c3)ncc2Cl)c1

nearest known ligand 0.72

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BTK Q06187 9/20 0.72
EGFR P00533 4/20 0.71
FGFR2 P21802 3/20 0.65
FGFR1 P11362 2/20 0.60
KDR P35968 2/20 0.60
JAK3 P52333 6/20 0.54
CDK7 P50613 1/20 0.54
CCNH P51946 1/20 0.54
JAK2 O60674 2/20 0.52
BLK P51451 1/20 0.52
BMX P51813 1/20 0.52
JAK1 P23458 1/20 0.51
TTK P33981 1/20 0.51

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
SCHEMBL17071472 0.91 BTK (0.73) BTKEGFRFGFR2JAK3CDK7
SCHEMBL17062815 0.90 BTK (0.87) BTKEGFRFGFR1KDRJAK3
SCHEMBL17071639 0.89 BTK (0.65) BTKEGFRFGFR2FGFR1KDR
SCHEMBL17071650 0.88 BTK (0.61) BTKEGFRFGFR2FGFR1KDR
SCHEMBL15637613 0.87 BTK (0.72) BTKEGFRJAK3CDK7CCNH
SCHEMBL15640174 0.87 BTK (0.89) BTKEGFRJAK3JAK2BLK
SCHEMBL17071649 0.87 BTK (0.62) BTKEGFRFGFR2JAK3
SCHEMBL17071637 0.86 BTK (0.62) BTKEGFRFGFR2FGFR1KDR
SCHEMBL17071634 0.86 BTK (0.70) BTKEGFRJAK3CDK7CCNH
SCHEMBL17071633 0.86 BTK (0.73) BTKEGFRJAK3CDK7CCNH

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 1/4885EGFR 294/4885FGFR2 2052/4885
US-20180134719-A1 SUBSTITUTED N-(3-(PYRIMIDIN-4-YL)PHENYL)ACRYLAMIDE ANALOGS AS TYROSINE RECEPTOR KINASE BTK INHIBITORS BTK, SYK, LYN BTK 1/4885EGFR 323/4885FGFR2 2120/4885

“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.