SCHEMBL2631407

SCHEMBL2631407

Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)nn2C1CCC(N)CC1

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BTK Q06187 19/20 0.84
LCK P06239 4/20 0.84
LYN P07948 2/20 0.84
NUDT14 O95848 2/20 0.78
NUDT5 Q9UKK9 2/20 0.78
SRC P12931 2/20 0.75
KDR P35968 1/20 0.75
TEK Q02763 1/20 0.75
EGFR P00533 3/20 0.68
ITK Q08881 2/20 0.68
ABL1 P00519 1/20 0.68
ERBB2 P04626 1/20 0.68
FYN P06241 1/20 0.68
YES1 P07947 1/20 0.68
HCK P08631 1/20 0.68
FGR P09769 1/20 0.68
FER P16591 1/20 0.68
CSK P41240 1/20 0.68
TEC P42680 1/20 0.68
BLK P51451 1/20 0.68

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
SCHEMBL15915382 1.00 BTK (0.84) BTKLCKLYNNUDT14NUDT5
SCHEMBL30586962 0.91 BTK (1.00) BTKLCKLYNNUDT14NUDT5
SCHEMBL6431516 0.91 BTK (1.00) BTKLCKLYNNUDT14NUDT5
SCHEMBL29441896 0.91 BTK (0.82) BTKLCKLYNNUDT14NUDT5
SCHEMBL7001715 0.91 BTK (0.82) BTKLCKLYNNUDT14NUDT5
SCHEMBL22243244 0.91 BTK (0.82) BTKLCKLYNNUDT14NUDT5
SCHEMBL22243281 0.91 BTK (0.82) BTKLCKLYNNUDT14NUDT5
SCHEMBL18645940 0.90 BTK (0.78) BTKLCKLYNNUDT14NUDT5
SCHEMBL17713980 0.90 BTK (0.98) BTKLCKLYNNUDT14NUDT5
SCHEMBL5803102 0.88 BTK (0.82) BTKLCKLYNNUDT14NUDT5

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3248979-B1 NOVEL INHIBITOR OF FLT3 KINASE AND USE THEREOF HEFEI INST PHYSICAL SCI CAS (CN) 2021-04-14 EP disclosed
US-10266535-B2 Inhibitor of FLT3 kinase and use thereof HEFEI INSTITUTES OF PHYSICAL SCIENCE, CHINESE ACADEMY OF SCIENCES (CN) 2019-04-23 US disclosed
EP-2878601-B1 AGENT FOR TREATING OR CONTROLLING RECURRENCE OF ACUTE MYELOGENOUS LEUKEMIA RIKEN (JP) 2018-03-28 EP disclosed
US-20180030054-A1 NOVEL INHIBITOR OF FLT3 KINASE AND USE THEREOF HEFEI INSTITUTES OF PHYSICAL SCIENCE, CHINESE ACADEMY OF SCIENCES (CN) 2018-02-01 US disclosed
US-20180030054-A1 NOVEL INHIBITOR OF FLT3 KINASE AND USE THEREOF HEFEI INSTITUTES OF PHYSICAL SCIENCE, CHINESE ACADEMY OF SCIENCES (CN) 2018-02-01 US disclosed
EP-3248979-A1 NOVEL INHIBITOR OF FLT3 KINASE AND USE THEREOF Hefei Institutes of Physical Sicence, Chinese Academy of Sciences (CN) 2017-11-29 EP disclosed
US-9604988-B2 Agent for treating or inhibiting recurrence of acute myeloid leukemia RIKEN (JP) 2017-03-28 US disclosed
WO-2016115869-A1 NOVEL INHIBITOR OF FLT3 KINASE AND USE THEREOF 中国科学院合肥物质科学研究院 2016-07-28 WO disclosed
US-9376438-B2 Pyrazolopyrimidine derivatives as tyrosine kinase inhibitors PRINCIPIA BIOPHARMA, INC. (US) 2016-06-28 US disclosed
US-9376438-B2 Pyrazolopyrimidine derivatives as tyrosine kinase inhibitors PRINCIPIA BIOPHARMA, INC. (US) 2016-06-28 US disclosed
US-20140221398-A1 PYRAZOLOPYRIMIDINE DERIVATIVES AS TYROSINE KINASE INHIBITORS PRINCIPIA BIOPHARMA INC. (US) 2014-08-07 US disclosed
US-20140221398-A1 PYRAZOLOPYRIMIDINE DERIVATIVES AS TYROSINE KINASE INHIBITORS PRINCIPIA BIOPHARMA INC. (US) 2014-08-07 US disclosed
US-20140221398-A1 PYRAZOLOPYRIMIDINE DERIVATIVES AS TYROSINE KINASE INHIBITORS PRINCIPIA BIOPHARMA INC. (US) 2014-08-07 US disclosed
EP-2532235-A1 Inhibitors of bruton's tyrosine kinase Pharmacyclics, Inc. (US) 2012-12-12 EP disclosed
EP-2532234-A1 Inhibitors of bruton's tyrosine kinase Pharmacyclics, Inc. (US) 2012-12-12 EP disclosed
EP-2529621-A1 Inhibitors of bruton's tyrosine kinase Pharmacyclics, Inc. (US) 2012-12-05 EP disclosed
EP-2529622-A1 Inhibitors of bruton's tyrosine kinase Pharmacyclics, Inc. (US) 2012-12-05 EP disclosed
EP-2530083-A1 Inhibitors of bruton's tyrosine kinase Pharmacyclics, Inc. (US) 2012-12-05 EP disclosed
EP-2443929-A1 Inhibitors of Bruton's Tyrosine Kinase Pharmacyclics, Inc. (US) 2012-04-25 EP disclosed
EP-2201840-A1 Inhibitors of Bruton's Tyrosine Kinase Pharmacyclics, Inc. (US) 2010-06-30 EP 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 (3 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-20180030054-A1 NOVEL INHIBITOR OF FLT3 KINASE AND USE THEREOF FLT3, FLT1, FGFR1 BTK 32/4885LCK 114/4885LYN 145/4885
US-20140221398-A1 PYRAZOLOPYRIMIDINE DERIVATIVES AS TYROSINE KINASE INHIBITORS BMX, BLK, TEC BTK 5/4885LCK 14/4885LYN 24/4885
US-10266535-B2 Inhibitor of FLT3 kinase and use thereof FLT3, FLT1, FGFR1 BTK 35/4885LCK 148/4885LYN 176/4885

“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.