SCHEMBL14706382

SCHEMBL14706382

CN(C)C/C=C/C(=O)Nc1cccc(-n2nc(I)c3c(N)ncnc32)c1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 6/20 0.49
▸ FLT3 P36888 2/20 0.46
▸ BLK P51451 2/20 0.46
▸ JAK3 P52333 5/20 0.45
▸ JAK2 O60674 3/20 0.45
▸ JAK1 P23458 1/20 0.45
▸ ERBB2 P04626 1/20 0.45
▸ FGFR2 P21802 1/20 0.44
▸ PIP4K2A P48426 4/20 0.44
▸ PIP4K2B P78356 4/20 0.44
▸ SRC P12931 2/20 0.44
▸ BTK Q06187 3/20 0.42
▸ ITK Q08881 3/20 0.42

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
SCHEMBL14706384 0.91 FGFR2 (0.42) EGFRFLT3BLKJAK3JAK2
SCHEMBL14706375 0.89 FGFR2 (0.45) EGFRFLT3BLKJAK3JAK2
SCHEMBL14693451 0.85 SRC (0.53) EGFRJAK3SRCBTKITK
SCHEMBL14693455 0.85 SRC (0.53) EGFRJAK3SRCBTKITK
SCHEMBL14693423 0.83 BTK (0.53) EGFRFGFR2SRCBTKITK
SCHEMBL14693422 0.83 BTK (0.53) EGFRFGFR2SRCBTKITK
SCHEMBL14706388 0.81 JAK3 (0.47) EGFRFLT3BLKJAK3JAK2
SCHEMBL14693470 0.77 BTK (0.46) EGFRFGFR2BTKITK
SCHEMBL14693472 0.77 BTK (0.46) EGFRFGFR2BTKITK
SCHEMBL14693495 0.77 SRC (0.49) EGFRSRCBTKITK

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
US-9546172-B2 Pyrazolo[3,4-d]pyrimidine and pyrazolo[2,3-d]pyrimidine compounds as kinase inhibitors PHARMACYCLICS LLC (US) 2017-01-17 — — US disclosed
US-9546172-B2 Pyrazolo[3,4-d]pyrimidine and pyrazolo[2,3-d]pyrimidine compounds as kinase inhibitors PHARMACYCLICS LLC (US) 2017-01-17 — — US disclosed
US-9273051-B2 Pyrazolo[3,4-d]pyrimidine and pyrrolo[2,3-d]pyrimidine compounds as kinase inhibitors PHARMACYCLICS LLC (US) 2016-03-01 — — US disclosed
US-9273051-B2 Pyrazolo[3,4-d]pyrimidine and pyrrolo[2,3-d]pyrimidine compounds as kinase inhibitors PHARMACYCLICS LLC (US) 2016-03-01 — — US disclosed
US-20130172314-A1 PYRAZOLO[3,4-d]PYRIMIDINE AND PYRROLO[2,3-d]PYRIMIDINE COMPOUNDS AS KINASE INHIBITORS PHARMACYCLICS, INC. (US) 2013-07-04 — — US disclosed
US-20130172314-A1 PYRAZOLO[3,4-d]PYRIMIDINE AND PYRROLO[2,3-d]PYRIMIDINE COMPOUNDS AS KINASE INHIBITORS PHARMACYCLICS, INC. (US) 2013-07-04 — — US disclosed
US-8377946-B1 Pyrazolo[3,4-d]pyrimidine and pyrrolo[2,3-d]pyrimidine compounds as kinase inhibitors PHARMACYCLICS, INC. (US) 2013-02-19 — — US disclosed
US-8377946-B1 Pyrazolo[3,4-d]pyrimidine and pyrrolo[2,3-d]pyrimidine compounds as kinase inhibitors PHARMACYCLICS, INC. (US) 2013-02-19 — — 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 (1 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-20130172314-A1 PYRAZOLO[3,4-d]PYRIMIDINE AND PYRROLO[2,3-d]PYRIMIDINE COMPOUNDS AS KINASE INHIBITORS BTK, LCK, LYN EGFR 1715/4885FLT3 58/4885BLK 16/4885

“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.

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