SCHEMBL17062815

SCHEMBL17062815

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

nearest known ligand 0.87

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BTK Q06187 10/20 0.87
JAK3 P52333 7/20 0.64
EGFR P00533 5/20 0.64
JAK2 O60674 3/20 0.64
BLK P51451 3/20 0.64
BMX P51813 2/20 0.64
PAK1 Q13153 1/20 0.61
SRC P12931 3/20 0.58
FLT3 P36888 3/20 0.58
FGFR1 P11362 2/20 0.58
MAP3K7 O43318 1/20 0.58
MAPK1 P28482 1/20 0.58
MAP2K1 Q02750 1/20 0.58
KDR P35968 1/20 0.58
ITK Q08881 2/20 0.58
PLK4 O00444 1/20 0.58
GAK O14976 1/20 0.58
NUAK1 O60285 1/20 0.58
CTSC P53634 1/20 0.58
PTK2 Q05397 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
SCHEMBL10127962 0.93 BTK (1.00) BTKJAK3EGFRJAK2BLK
SCHEMBL17071633 0.91 BTK (0.73) BTKJAK3EGFRJAK2BLK
SCHEMBL17071472 0.91 BTK (0.73) BTKJAK3EGFRJAK2BLK
SCHEMBL17071642 0.90 BTK (0.72) BTKJAK3EGFRJAK2BLK
SCHEMBL17071652 0.90 BTK (0.71) BTKJAK3EGFRJAK2BLK
SCHEMBL15637613 0.90 BTK (0.72) BTKJAK3EGFRJAK2BLK
SCHEMBL17071757 0.90 BTK (0.71) BTKJAK3EGFRJAK2BLK
SCHEMBL15640174 0.90 BTK (0.89) BTKJAK3EGFRJAK2BLK
SCHEMBL17071634 0.89 BTK (0.70) BTKJAK3EGFRJAK2BLK
SCHEMBL22213176 0.89 BTK (0.70) BTKJAK3EGFRJAK2BLK

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 8 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
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-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-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
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 41/4885EGFR 294/4885
US-20180134719-A1 SUBSTITUTED N-(3-(PYRIMIDIN-4-YL)PHENYL)ACRYLAMIDE ANALOGS AS TYROSINE RECEPTOR KINASE BTK INHIBITORS BTK, SYK, LYN BTK 1/4885JAK3 58/4885EGFR 323/4885

“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.