SCHEMBL13860550

SCHEMBL13860550

CC(C)(C)OC(=O)N1CCCC1Cn1cc(-c2ccc(Oc3ccccc3)cc2)c2c(N)ncnc21

nearest known ligand 0.70

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 18/20 0.70
▸ SRC P12931 3/20 0.65
▸ LCK P06239 2/20 0.65
▸ FYN P06241 1/20 0.65
▸ YES1 P07947 1/20 0.65
▸ LYN P07948 1/20 0.65
▸ HCK P08631 1/20 0.65
▸ FGR P09769 1/20 0.65
▸ TEC P42680 1/20 0.65
▸ TXK P42681 1/20 0.65
▸ BLK P51451 1/20 0.65
▸ BMX P51813 1/20 0.65
▸ ERBB4 Q15303 1/20 0.65
▸ TEK Q02763 1/20 0.56

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
SCHEMBL13860549 1.00 BTK (0.70) BTKSRCLCKFYNYES1
SCHEMBL15517353 0.90 BTK (0.69) BTK
SCHEMBL463456 0.84 BTK (0.75) BTKLCK
SCHEMBL410260 0.84 BTK (0.75) BTKLCK
SCHEMBL25591499 0.84 BTK (0.89) BTKSRCLCKFYNYES1
SCHEMBL18925740 0.84 BTK (0.53) BTKSRCLCKFYNYES1
SCHEMBL18533039 0.83 BTK (0.79) BTKSRCLCKFYNYES1
SCHEMBL19731424 0.82 BTK (0.48) BTKSRC
SCHEMBL19296677 0.82 BTK (0.58) BTKSRCLCKFYNYES1
SCHEMBL15516734 0.81 BTK (1.00) BTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9572811-B2 Treatment of dry eye PRINCIPIA BIOPHARMA INC. (US) 2017-02-21 — — US disclosed
EP-2710005-B1 TYROSINE KINASE INHIBITORS PRINCIPIA BIOPHARMA INC (US) 2016-10-05 — — EP disclosed
US-9376438-B2 Pyrazolopyrimidine derivatives as tyrosine kinase inhibitors PRINCIPIA BIOPHARMA, INC. (US) 2016-06-28 — — US disclosed
US-20150353557-A1 TYROSINE KINASE INHIBITORS PRINCIPIA BIOPHARMA INC. (US) 2015-12-10 — — US disclosed
US-20150353562-A1 TYROSINE KINASE INHIBITORS PRINCIPIA BIOPHARMA INC. (US) 2015-12-10 — — US disclosed
US-9090621-B2 Tyrosine kinase inhibitors PRINCIPIA BIOPHARMA INC. (US) 2015-07-28 — — US disclosed
US-20150182530-A1 TREATMENT OF DRY EYE PRINCIPIA BIOPHARMA INC. (US) 2015-07-02 — — US disclosed
US-8962831-B2 Tyrosine kinase inhibitors PRINCIPIA BIOPHARMA INC. (US) 2015-02-24 — — US disclosed
US-8962635-B2 Tyrosine kinase inhibitors PRINCIPIA BIOPHARMA INC. (US) 2015-02-24 — — US disclosed
US-8957080-B2 Tyrosine kinase inhibitors PRINCIPIA BIOPHARMA INC. (US) 2015-02-17 — — US disclosed
US-8946241-B2 Tyrosine kinase inhibitors PRINCIPIA BIOPHARMA INC. (US) 2015-02-03 — — US disclosed
US-20140336382-A1 TYROSINE KINASE INHIBITORS PRINCIPIA BIOPHARMA INC. (US) 2014-11-13 — — US disclosed
US-20140309223-A1 TYROSINE KINASE INHIBITORS PRINCIPIA BIOPHARMA INC. (US) 2014-10-16 — — US disclosed
US-20140303161-A1 TYROSINE KINASE INHIBITORS PRINCIPIA BIOPHARMA INC. 2014-10-09 — — US disclosed
US-20140303190-A1 TYROSINE KINASE INHIBITORS PRINCIPIA BIOPHARMA INC. (US) 2014-10-09 — — US disclosed
US-20140221398-A1 PYRAZOLOPYRIMIDINE DERIVATIVES AS TYROSINE KINASE INHIBITORS PRINCIPIA BIOPHARMA INC. (US) 2014-08-07 — — US disclosed
US-8759358-B1 Tyrosine kinase inhibitors PRINCIPIA BIOPHARMA INC. (US) 2014-06-24 — — US disclosed
US-8673925-B1 Tyrosine kinase inhibitors PRINCIPIA BIOPHARMA INC. (US) 2014-03-18 — — US disclosed
WO-2012158795-A1 PYRAZOLOPYRIMIDINE DERIVATIVES AS TYROSINE KINASE INHIBITORS PRINCIPIA BIOPHARMA INC. (US) 2012-11-22 — — 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 (8 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-20150353557-A1 TYROSINE KINASE INHIBITORS BMX, ITK, BLK BTK 4/4885SRC 18/4885LCK 10/4885
US-20140303161-A1 TYROSINE KINASE INHIBITORS BMX, ITK, BLK BTK 4/4885SRC 18/4885LCK 10/4885
US-20150353562-A1 TYROSINE KINASE INHIBITORS BMX, ITK, BLK BTK 4/4885SRC 18/4885LCK 10/4885
US-20140303190-A1 TYROSINE KINASE INHIBITORS BMX, ITK, BLK BTK 4/4885SRC 18/4885LCK 10/4885
US-20140336382-A1 TYROSINE KINASE INHIBITORS BMX, ITK, BLK BTK 4/4885SRC 18/4885LCK 10/4885
US-20140221398-A1 PYRAZOLOPYRIMIDINE DERIVATIVES AS TYROSINE KINASE INHIBITORS BMX, BLK, TEC BTK 5/4885SRC 25/4885LCK 14/4885
US-20140309223-A1 TYROSINE KINASE INHIBITORS BMX, ITK, BLK BTK 4/4885SRC 18/4885LCK 10/4885
US-20150182530-A1 TREATMENT OF DRY EYE BTK, SYK, LYN BTK 1/4885SRC 8/4885LCK 4/4885

“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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