SCHEMBL14706417

SCHEMBL14706417

COc1cc(-c2nn(-c3ccc(N(C)C(=O)/C=C/CN(C)C)c(F)c3)c3ncnc(N)c23)ccc1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 13/20 0.42
▸ EGFR P00533 10/20 0.42
▸ ABL1 P00519 9/20 0.42
▸ PIK3CD O00329 8/20 0.42
▸ HCK P08631 8/20 0.42
▸ PIK3CA P42336 8/20 0.42
▸ PIK3CB P42338 8/20 0.42
▸ MTOR P42345 8/20 0.42
▸ PIK3CG P48736 8/20 0.42
▸ EPHB4 P54760 8/20 0.42
▸ PRKDC P78527 8/20 0.42
▸ PI4KB Q9UBF8 7/20 0.42
▸ KDR P35968 7/20 0.42
▸ RIPK1 Q13546 1/20 0.41
▸ FGFR1 P11362 1/20 0.40
▸ FGFR2 P21802 1/20 0.40
▸ FGFR3 P22607 1/20 0.40
▸ BTK Q06187 4/20 0.40
▸ LCK P06239 3/20 0.40
▸ ITK Q08881 2/20 0.40

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
SCHEMBL14706416 0.95 SRC (0.44) SRCEGFRABL1PIK3CDHCK
SCHEMBL15086973 0.93 FGFR1 (0.42) SRCEGFRABL1PIK3CDHCK
SCHEMBL14706422 0.93 RIPK1 (0.41) SRCEGFRABL1PIK3CDHCK
SCHEMBL14706405 0.91 FGFR1 (0.40) SRCEGFRABL1PIK3CDHCK
SCHEMBL15086968 0.90 FGFR1 (0.40) SRCEGFRABL1PIK3CDHCK
SCHEMBL14693583 0.89 BTK (0.43) SRCEGFRABL1PIK3CDHCK
SCHEMBL14693582 0.89 BTK (0.43) SRCEGFRABL1PIK3CDHCK
SCHEMBL14706431 0.88 SRC (0.42) SRCEGFRABL1PIK3CDHCK
SCHEMBL14706424 0.88 FGFR1 (0.40) SRCEGFRABL1PIK3CDHCK
SCHEMBL14706430 0.88 EGFR (0.42) SRCEGFRABL1PIK3CDHCK

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-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
WO-2013102059-A1 PYRAZOLO [3, 4-D] PYRIMIDINE AND PYRROLO [2, 3-D] PYRIMIDINE COMPOUNDS AS KINASE INHIBITORS PHARMACYCLICS, INC. (US) 2013-07-04 — — WO 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 SRC 43/4885EGFR 1715/4885ABL1 108/4885

“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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