SCHEMBL14706375

SCHEMBL14706375

CN(C)C/C=C/C(=O)Nc1ccc(-n2nc(I)c3c(N)ncnc32)cc1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ FGFR2 P21802 4/20 0.45
▸ FGFR1 P11362 3/20 0.45
▸ KDR P35968 2/20 0.45
▸ FLT1 P17948 1/20 0.45
▸ KCNH2 Q12809 1/20 0.45
▸ EGFR P00533 9/20 0.43
▸ PIP4K2A P48426 4/20 0.43
▸ PIP4K2B P78356 4/20 0.43
▸ BTK Q06187 2/20 0.41
▸ LCK P06239 1/20 0.41
▸ ITK Q08881 1/20 0.41
▸ FLT3 P36888 1/20 0.41
▸ BLK P51451 1/20 0.41
▸ ERBB2 P04626 3/20 0.40
▸ JAK2 O60674 2/20 0.39
▸ JAK1 P23458 1/20 0.38
▸ JAK3 P52333 1/20 0.38

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
SCHEMBL14706382 0.89 EGFR (0.49) FGFR2EGFRPIP4K2APIP4K2BBTK
SCHEMBL14693528 0.84 SRC (0.54) FGFR2FGFR1KDRFLT1KCNH2
SCHEMBL14693527 0.84 SRC (0.54) FGFR2FGFR1KDRFLT1KCNH2
SCHEMBL14693472 0.84 BTK (0.46) FGFR2FGFR1KDREGFRBTK
SCHEMBL14693470 0.84 BTK (0.46) FGFR2FGFR1KDREGFRBTK
SCHEMBL14706377 0.82 JAK2 (0.49) FGFR2FGFR1EGFRBTKJAK2
SCHEMBL14706384 0.80 FGFR2 (0.42) FGFR2EGFRPIP4K2APIP4K2BBTK
SCHEMBL14693477 0.80 BTK (0.46) FGFR2FGFR1KDRFLT1KCNH2
SCHEMBL14693480 0.80 BTK (0.46) FGFR2FGFR1KDRFLT1KCNH2
SCHEMBL14693422 0.77 BTK (0.53) FGFR2KDREGFRBTKLCK

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 FGFR2 983/4885FGFR1 1752/4885KDR 1397/4885

“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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