SCHEMBL1707115

SCHEMBL1707115

C=CC(=O)Nc1ccc(Oc2nc(Nc3ccc(N4CCN(C)CC4)cc3)ncc2Cl)cc1

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 6/20 0.83
JAK3 P52333 3/20 0.83
BLK P51451 3/20 0.83
JAK2 O60674 2/20 0.83
BMX P51813 2/20 0.83
MAP3K7 O43318 10/20 0.77
MAP2K1 Q02750 7/20 0.77
MAPK1 P28482 4/20 0.77
FLT3 P36888 3/20 0.77
SRC P12931 3/20 0.67
FGFR1 P11362 2/20 0.67
BTK Q06187 2/20 0.66
CTSC P53634 2/20 0.66
PLK4 O00444 1/20 0.66
GAK O14976 1/20 0.66
NUAK1 O60285 1/20 0.66
PTK2 Q05397 1/20 0.66
ITK Q08881 1/20 0.66
ERBB4 Q15303 1/20 0.66
DCLK3 Q9C098 1/20 0.66

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
SCHEMBL29351880 0.91 EGFR (1.00) EGFRJAK3BLKJAK2BMX
SCHEMBL30854720 0.91 EGFR (1.00) EGFRJAK3BLKJAK2BMX
SCHEMBL93510 0.91 EGFR (1.00) EGFRJAK3BLKJAK2BMX
SCHEMBL10127920 0.90 EGFR (0.81) EGFRJAK3BLKJAK2BMX
SCHEMBL10127807 0.88 EGFR (0.78) EGFRJAK3BLKJAK2BMX
SCHEMBL10155134 0.88 EGFR (1.00) EGFRJAK3BLKJAK2BMX
SCHEMBL28980965 0.88 MAP3K7 (0.81) EGFRJAK3BLKJAK2BMX
SCHEMBL18018867 0.84 MAP3K7 (0.73) EGFRJAK3BLKJAK2BMX
SCHEMBL1706135 0.83 EGFR (0.72) EGFRJAK3BLKJAK2BMX
SCHEMBL17209773 0.82 JAK3 (0.83) EGFRJAK3BLKJAK2BMX

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190040065-A1 EGFR Inhibitors and Methods of Treating Disorders DANA-FARBER CANCER INSTITUTE, INC. 2019-02-07 US disclosed
US-20190040065-A1 EGFR Inhibitors and Methods of Treating Disorders DANA-FARBER CANCER INSTITUTE, INC. 2019-02-07 US disclosed
US-9908884-B2 EGFR inhibitors and methods of treating disorders DANA-FARBER CANCER INSTITUTE, INC. (US) 2018-03-06 US disclosed
US-9908884-B2 EGFR inhibitors and methods of treating disorders DANA-FARBER CANCER INSTITUTE, INC. (US) 2018-03-06 US disclosed
EP-2440559-B1 EGFR INHIBITORS AND METHODS OF TREATING DISORDERS DANA FARBER CANCER INST INC (US) 2018-01-10 EP disclosed
US-20120094999-A1 EGFR INHIBITORS AND METHODS OF TREATING DISORDERS DANA-FARBER CANCER INSTITUTE, INC. (US) 2012-04-19 US disclosed
US-20120094999-A1 EGFR INHIBITORS AND METHODS OF TREATING DISORDERS DANA-FARBER CANCER INSTITUTE, INC. (US) 2012-04-19 US disclosed
EP-2440559-A2 EGFR INHIBITORS AND METHODS OF TREATING DISORDERS Dana-Farber Cancer Institute, Inc. (US) 2012-04-18 EP disclosed
WO-2010129053-A2 EGFR INHIBITORS AND METHODS OF TREATING DISORDERS DANA FARBER CANCER INSTITUTE (US) 2010-11-11 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-20120094999-A1 EGFR INHIBITORS AND METHODS OF TREATING DISORDERS EGFR, ERBB2, ERBB4 EGFR 1/4885JAK3 37/4885BLK 111/4885
US-20190040065-A1 EGFR Inhibitors and Methods of Treating Disorders EGFR, ERBB2, ERBB4 EGFR 1/4885JAK3 37/4885BLK 111/4885

“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.