SCHEMBL17626654

SCHEMBL17626654

Nc1ncnc2[nH]nc(-c3ccc(Oc4ccc(F)cc4)cc3)c12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NUDT14 O95848 2/20 0.48
NUDT5 Q9UKK9 2/20 0.48
PIK3CD O00329 2/20 0.48
PIK3CA P42336 2/20 0.48
PIK3CB P42338 2/20 0.48
PIK3CG P48736 2/20 0.48
PRKDC P78527 2/20 0.48
SCN9A Q15858 3/20 0.44
SGK1 O00141 1/20 0.44
MEN1 O00255 1/20 0.44
DYRK3 O43781 1/20 0.44
EIF4E P06730 1/20 0.44
EIF2AK2 P19525 1/20 0.44
MTOR P42345 1/20 0.44
CSNK1D P48730 1/20 0.44
KMT2A Q03164 1/20 0.44
BRSK2 Q8IWQ3 1/20 0.44
AURKB Q96GD4 1/20 0.44
MKNK1 Q9BUB5 1/20 0.44
MKNK2 Q9HBH9 1/20 0.44

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
SCHEMBL14617841 0.88 BTK (0.52) NUDT14NUDT5PIK3CDPIK3CAPIK3CB
SCHEMBL200349 0.88 NUDT14 (0.62) NUDT14NUDT5PIK3CDPIK3CAPIK3CB
SCHEMBL12808147 0.86 BTK (0.50) NUDT14NUDT5PIK3CDPIK3CAPIK3CB
SCHEMBL12713498 0.86 PIK3CD (0.50) NUDT14NUDT5PIK3CDPIK3CAPIK3CB
Hydrochloric Acid SCHEMBL29439185 0.86 NUDT14 (0.61) NUDT14NUDT5PIK3CDPIK3CAPIK3CB
SCHEMBL18235468 0.86 KDR (0.49) NUDT14NUDT5PIK3CDPIK3CAPIK3CB
SCHEMBL30415900 0.86 FYN (0.47) NUDT14NUDT5PIK3CDPIK3CAPIK3CB
SCHEMBL22692848 0.86 FYN (0.47) NUDT14NUDT5PIK3CDPIK3CAPIK3CB
SCHEMBL30416234 0.86 PIK3CA (0.45) NUDT14NUDT5PIK3CDPIK3CAPIK3CB
SCHEMBL22243273 0.82 PIK3CD (0.41) NUDT14NUDT5PIK3CDPIK3CAPIK3CB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12384786-B2 Cyclic molecules as Bruton's tyrosine kinase inhibitor MINGHUI PHARMACEUTICAL SHANGHAI LTD (CN) 2025-08-12 US disclosed
CN-111454268-B Cyclic molecules as inhibitors of bruton's tyrosine kinase 明慧医药(上海)有限公司 2023-09-08 CN disclosed
CN-116589465-A Cyclic molecules as inhibitors of bruton's tyrosine kinase 明慧医药(上海)有限公司 2023-08-15 CN disclosed
CN-116134028-A Compound capable of degrading BTK kinase, preparation method and pharmaceutical application thereof 四川海思科制药有限公司 2023-05-16 CN disclosed
CN-113710671-B Cyclic molecules as inhibitors of bruton's tyrosine kinase 明慧医药(上海)有限公司 2023-04-28 CN disclosed
US-20220081445-A1 CYCLIC MOLECULES AS BRUTON'S TYROSINE KINASE INHIBITOR MINGHUI PHARMACEUTICAL SHANGHAI LTD (CN) 2022-03-17 US disclosed
EP-3912980-A1 CYCLIC MOLECULES AS BRUTON'S TYROSINE KINASE INHIBITOR Minghui Pharmaceutical (Shanghai) Limited (CN) 2021-11-24 EP disclosed
EP-3912980-A1 CYCLIC MOLECULES AS BRUTON'S TYROSINE KINASE INHIBITOR Minghui Pharmaceutical (Shanghai) Limited (CN) 2021-11-24 EP disclosed
WO-2020147798-A1 CYCLIC MOLECULES AS BRUTON'S TYROSINE KINASE INHIBITOR 明慧医药(上海)有限公司 2020-07-23 WO disclosed
US-9694011-B2 Substituted pyrazolopyrimidines as kinases inhibitors JIANGSU MEDOLUTION LTD (CN) 2017-07-04 US disclosed
US-9694011-B2 Substituted pyrazolopyrimidines as kinases inhibitors JIANGSU MEDOLUTION LTD (CN) 2017-07-04 US disclosed
US-9694011-B2 Substituted pyrazolopyrimidines as kinases inhibitors JIANGSU MEDOLUTION LTD (CN) 2017-07-04 US disclosed
US-20160120868-A1 SUBSTITUTED PYRAZOLOPYRIMIDINES AS KINASES INHIBITORS JIANGSU MEDOLUTION LTD. (CN) 2016-05-05 US disclosed
US-20160120868-A1 SUBSTITUTED PYRAZOLOPYRIMIDINES AS KINASES INHIBITORS JIANGSU MEDOLUTION LTD. (CN) 2016-05-05 US disclosed
US-20160120868-A1 SUBSTITUTED PYRAZOLOPYRIMIDINES AS KINASES INHIBITORS JIANGSU MEDOLUTION LTD. (CN) 2016-05-05 US disclosed
EP-2999702-A1 SUBSTITUTED PYRAZOLOPYRIMIDINES AS KINASES INHIBITORS Jiangsu Medolution Ltd. (CN) 2016-03-30 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-20160120868-A1 SUBSTITUTED PYRAZOLOPYRIMIDINES AS KINASES INHIBITORS BTK, LCK, ABL1 NUDT14 1946/4885NUDT5 1199/4885PIK3CD 224/4885
US-12384786-B2 Cyclic molecules as Bruton's tyrosine kinase inhibitor ABL1, BTK, LYN NUDT14 2861/4885NUDT5 2600/4885PIK3CD 355/4885
US-20220081445-A1 CYCLIC MOLECULES AS BRUTON'S TYROSINE KINASE INHIBITOR ABL1, BTK, LYN NUDT14 2861/4885NUDT5 2600/4885PIK3CD 355/4885

“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.