SCHEMBL130529

SCHEMBL130529

Cn1nc(-c2ccc(Oc3ccccc3)cc2)c2c(N)ncnc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NUDT14 O95848 2/20 1.00
NUDT5 Q9UKK9 2/20 1.00
PIK3CD O00329 7/20 0.74
PIK3CA P42336 7/20 0.74
PIK3CB P42338 7/20 0.74
PIK3CG P48736 7/20 0.74
PRKDC P78527 7/20 0.74
SRC P12931 8/20 0.67
KDR P35968 7/20 0.67
EGFR P00533 7/20 0.67
ABL1 P00519 5/20 0.67
HCK P08631 5/20 0.67
MTOR P42345 5/20 0.67
EPHB4 P54760 5/20 0.67
BTK Q06187 10/20 0.66
LCK P06239 6/20 0.65
LYN P07948 1/20 0.65
TEK Q02763 3/20 0.61
JAK3 P52333 2/20 0.59
ITK Q08881 2/20 0.59

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
SCHEMBL409367 0.88 PIK3CD (0.82) NUDT14NUDT5PIK3CDPIK3CAPIK3CB
SCHEMBL15613570 0.87 PIK3CD (0.81) NUDT14NUDT5PIK3CDPIK3CAPIK3CB
SCHEMBL22692820 0.86 NUDT14 (0.75) NUDT14NUDT5PIK3CDPIK3CAPIK3CB
SCHEMBL18176199 0.86 NUDT14 (0.75) NUDT14NUDT5PIK3CDPIK3CAPIK3CB
SCHEMBL130425 0.85 PIK3CD (1.00) NUDT14NUDT5PIK3CDPIK3CAPIK3CB
SCHEMBL130752 0.85 NUDT14 (0.74) NUDT14NUDT5PIK3CDPIK3CAPIK3CB
SCHEMBL22692814 0.84 NUDT14 (0.72) NUDT14NUDT5PIK3CDPIK3CAPIK3CB
SCHEMBL22909341 0.84 NUDT14 (0.72) NUDT14NUDT5PIK3CDPIK3CAPIK3CB
SCHEMBL24192635 0.84 NUDT14 (0.72) NUDT14NUDT5PIK3CDPIK3CAPIK3CB
SCHEMBL25069027 0.84 SRC (0.76) 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 38 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024086361-A1 MOLECULAR GLUE DEGRADER COMPOUNDS AND USES THEREOF NOVARTIS AG (CH) 2024-04-25 WO disclosed
US-11858907-B2 Kinase modulators RHIZEN PHARMACEUTICALS AG (CH) 2024-01-02 US disclosed
WO-2023104155-A1 LIGAND COMPOUNDS FOR E3 UBIQUITIN LIGASE, PROTEIN DEGRADERS DEVELOPED ON BASIS OF LIGAND COMPOUNDS, AND USES THEREOF 标新生物医药科技(上海)有限公司 2023-06-15 WO disclosed
WO-2023066350-A1 CRBN E3 LIGASE LIGAND COMPOUND, PROTEIN DEGRADING AGENT DEVELOPED ON THE BASIS OF LIGAND COMPOUND, AND THEIR APPLICATIONS 标新生物医药科技(上海)有限公司 2023-04-27 WO disclosed
US-20230126711-A1 ENTERIC NITRERGIC NEURONS AND METHODS OF USING THE SAME THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-04-27 US disclosed
US-20230126711-A1 ENTERIC NITRERGIC NEURONS AND METHODS OF USING THE SAME THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-04-27 US disclosed
US-20230055961-A1 PENTAFLUOROBENZENESULFONAMIDE DERIVATIVES AND USES THEREOF DUNAD THERAPEUTICS LTD. (GB) 2023-02-23 US disclosed
WO-2023284703-A1 PROTEIN DEGRADATION COMPOUND DESIGNED ON THE BASIS OF BRUTON'S TYROSINE KINASE LIGAND AND APPLICATION THEREOF 标新生物医药科技(上海)有限公司 2023-01-19 WO disclosed
US-11542266-B1 Substituted piperidines as BTK inhibitors HAISCO PHARMACEUTICALS PTE. LTD. (SG) 2023-01-03 US disclosed
WO-2022253250-A1 BRUTON'S TYROSINE KINASE DEGRADER CONTAINING FUSED-RING OR SPIRO-RING 正大天晴药业集团股份有限公司 2022-12-08 WO disclosed
US-20150320752-A1 NOVEL COMPOUNDS AS MODULATORS OF PROTEIN KINASES RHIZEN PHARMACEUTICALS AG (CH) 2015-11-12 US disclosed
US-20150174131-A1 NOVEL KINASE MODULATORS RHIZEN PHARMACEUTICALS AG (CH) 2015-06-25 US disclosed
US-9018375-B2 Substituted chromenes as kinase modulators RHIZEN PHARMACEUTICALS SA (CH) 2015-04-28 US disclosed
US-8952015-B2 Inhibitors of Bruton's tyrosine kinase PHARMACYCLICS, INC. (US) 2015-02-10 US disclosed
US-20140080827-A1 NOVEL KINASE MODULATORS RHIZEN PHARMACEUTICALS SA (CH) 2014-03-20 US disclosed
US-8642607-B2 4H-chromen-4-one compounds as modulators of protein kinases RHIZEN PHARMACEUTICALS SA (CH) 2014-02-04 US disclosed
US-20120289496-A1 NOVEL COMPOUNDS AS MODULATORS OF PROTEIN KINASES RHIZEN PHARMACEUTICALS SA (CH) 2012-11-15 US disclosed
US-20120059001-A1 NOVEL KINASE MODULATORS INCOZEN THERAPEUTICS PVT. LTD. (IN) 2012-03-08 US disclosed
US-20110118257-A1 NOVEL KINASE MODULATORS RHIZEN PHARMACEUTICALS SA (CH) 2011-05-19 US disclosed
US-20110039868-A1 INHIBITORS OF BRUTON'S TYROSINE KINASE PHARMACYCLICS, INC. (US) 2011-02-17 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 (11 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-20150174131-A1 NOVEL KINASE MODULATORS PRKCA, PRKCH, PRKCB NUDT14 1304/4885NUDT5 2607/4885PIK3CD 70/4885
US-20150320752-A1 NOVEL COMPOUNDS AS MODULATORS OF PROTEIN KINASES PRKCA, PRKCH, PRKCB NUDT14 1403/4885NUDT5 2424/4885PIK3CD 47/4885
US-20120289496-A1 NOVEL COMPOUNDS AS MODULATORS OF PROTEIN KINASES PRKCA, PRKCH, PRKCB NUDT14 1403/4885NUDT5 2424/4885PIK3CD 47/4885
US-20140080827-A1 NOVEL KINASE MODULATORS PRKCA, PRKCH, PRKCB NUDT14 1304/4885NUDT5 2607/4885PIK3CD 70/4885
US-20230055961-A1 PENTAFLUOROBENZENESULFONAMIDE DERIVATIVES AND USES THEREOF FURIN, PFAS, CFTR NUDT14 1025/4885NUDT5 1619/4885PIK3CD 2856/4885
US-20110118257-A1 NOVEL KINASE MODULATORS PRKCA, PRKCH, PRKCB NUDT14 1304/4885NUDT5 2607/4885PIK3CD 70/4885
US-20110039868-A1 INHIBITORS OF BRUTON'S TYROSINE KINASE BTK, LCK, LYN NUDT14 3005/4885NUDT5 2890/4885PIK3CD 98/4885
US-11542266-B1 Substituted piperidines as BTK inhibitors BTK, BLK, SYK NUDT14 3824/4885NUDT5 2932/4885PIK3CD 49/4885
US-20230126711-A1 ENTERIC NITRERGIC NEURONS AND METHODS OF USING THE SAME PROX1, MYH2, NOS2 NUDT14 673/4885NUDT5 720/4885PIK3CD 3440/4885
US-11858907-B2 Kinase modulators RPS6KA1, RPS6KA2, PRKAR2A NUDT14 2673/4885NUDT5 3615/4885PIK3CD 103/4885
US-20120059001-A1 NOVEL KINASE MODULATORS PRKCA, PRKCH, PRKCB NUDT14 1304/4885NUDT5 2607/4885PIK3CD 70/4885

“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.