SCHEMBL950156

SCHEMBL950156

CC(C)(C)OC(=O)n1ccc2cc(CO[Si](C)(C)C(C)(C)C)ccc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 2/20 0.42
ABL1 P00519 2/20 0.42
EGFR P00533 2/20 0.42
HCK P08631 2/20 0.42
SRC P12931 2/20 0.42
KDR P35968 2/20 0.42
PIK3CA P42336 2/20 0.42
PIK3CB P42338 2/20 0.42
MTOR P42345 2/20 0.42
PIK3CG P48736 2/20 0.42
EPHB4 P54760 2/20 0.42
PRKDC P78527 2/20 0.42
PI4KB Q9UBF8 2/20 0.42
NR1H2 P55055 9/20 0.37
HTR6 P50406 1/20 0.36
USP14 P54578 1/20 0.36
NR1H3 Q13133 3/20 0.35
AKT1 P31749 1/20 0.35
OXER1 Q8TDS5 1/20 0.35
HSP90AA1 P07900 1/20 0.35

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
SCHEMBL1751204 0.91 USP14 (0.38) PIK3CDABL1EGFRHCKSRC
SCHEMBL3050311 0.84 PIK3CD (0.38) PIK3CDABL1EGFRHCKSRC
SCHEMBL3043931 0.82 FAAH (0.39) PIK3CDABL1EGFRHCKSRC
SCHEMBL1057433 0.81 PIK3CD (0.44) PIK3CDABL1EGFRHCKSRC
SCHEMBL12043978 0.81 PIK3CD (0.44) PIK3CDABL1EGFRHCKSRC
SCHEMBL29658586 0.81 PIK3CD (0.44) PIK3CDABL1EGFRHCKSRC
SCHEMBL3657760 0.81 PIK3CD (0.46) PIK3CDABL1EGFRHCKSRC
SCHEMBL16756072 0.80 NR1H2 (0.52) PIK3CDABL1EGFRHCKSRC
SCHEMBL1058348 0.80 PIK3CD (0.44) PIK3CDABL1EGFRHCKSRC
SCHEMBL10819613 0.80 PIK3CD (0.44) PIK3CDABL1EGFRHCKSRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0894235-B1 FIRING MIXTURES DYNAMIT NOBEL AG (DE) 2005-09-07 EP claimed
US-20200361905-A1 Indolyl-Pyridone Derivatives Having Checkpoint Kinase 1 Inhibitory Activity VERNALIS R&D LTD (GB) 2020-11-19 US disclosed
US-20200361905-A1 Indolyl-Pyridone Derivatives Having Checkpoint Kinase 1 Inhibitory Activity VERNALIS R&D LTD (GB) 2020-11-19 US disclosed
US-10696652-B2 Indolyl-pyridone derivatives having checkpoint kinase 1 inhibitory activity VERNALIS (R&D) LTD. (GB) 2020-06-30 US disclosed
US-10696652-B2 Indolyl-pyridone derivatives having checkpoint kinase 1 inhibitory activity VERNALIS (R&D) LTD. (GB) 2020-06-30 US disclosed
US-20180244652-A1 Indolyl-Pyridone Derivatives Having Checkpoint Kinase 1 Inhibitory Activity VERNALIS (R&D) LTD. (GB) 2018-08-30 US disclosed
US-20170298043-A1 Indolyl-Pyridone Derivatives Having Checkpoint Kinase 1 Inhibitory Activity VERNALIS (R&D) LTD. (GB) 2017-10-19 US disclosed
US-20170298043-A1 Indolyl-Pyridone Derivatives Having Checkpoint Kinase 1 Inhibitory Activity VERNALIS (R&D) LTD. (GB) 2017-10-19 US disclosed
US-9604975-B2 Indolyl-pyridone derivatives having checkpoint kinase 1 inhibitory activity VERNALIS (R&D) LTD (GB) 2017-03-28 US disclosed
US-20150099736-A1 Indolyl-Pyridone Derivatives Having Checkpoint Kinase 1 Inhibitory Activity VERNALIS (R&D) LTD (GB) 2015-04-09 US disclosed
EP-1496982-A2 SOLID FORMS OF SALTS WITH TYROSINE KINASE ACTIVITY Merck & Co., Inc. (US) 2003-10-30 EP disclosed
WO-2003088900-A2 SOLID FORMS OF SALTS WITH TYROSINE KINASE ACTIVITY MERCK & CO., INC. (US) 2003-10-30 WO disclosed
EP-1328519-A2 ORALLY ACTIVE SALTS WITH TYROSINE KINASE ACTIVITY Merck & Co., Inc. (US) 2003-07-23 EP disclosed
WO-2003057696-A1 DEAZAPURINES AND USES THEREOF EISAI CO. LTD. (JP) 2003-07-17 WO disclosed
WO-2003020699-A2 TYROSINE KINASE INHIBITORS MERCK & CO., INC. (US) 2003-03-13 WO disclosed
EP-1226136-A2 TYROSINE KINASE INHIBITORS Merck & Co., Inc. (US) 2002-07-31 EP disclosed
US-20020072526-A1 Orally active salts with tyrosine kinase activity MERCK & CO., INC. 2002-06-13 US disclosed
WO-2002032861-A2 ORALLY ACTIVE SALTS WITH TYROSINE KINASE ACTIVITY MERCK & CO., INC. (US) 2002-04-25 WO disclosed
US-6306874-B1 ENZYME INHIBITORS SUCH AS ANGIOGENESIS, CANCER, TUMOR GROWTH, ATHEROSCLEROSIS, AGE RELATED MACULAR DEGENERATION, DIABETIC RETINOPATHY, INFLAMMATORY DISEASES, AND THE LIKE IN MAMMALS. MERCK & CO., INC. 2001-10-23 US disclosed
WO-2001029025-A2 TYROSINE KINASE INHIBITORS MERCK & CO., INC. (US) 2001-04-26 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 (6 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-20170298043-A1 Indolyl-Pyridone Derivatives Having Checkpoint Kinase 1 Inhibitory Activity CHEK1, CHEK2, RAD1 PIK3CD 509/4885ABL1 111/4885EGFR 147/4885
US-20200361905-A1 Indolyl-Pyridone Derivatives Having Checkpoint Kinase 1 Inhibitory Activity CHEK2, CHEK1, BUB1B PIK3CD 460/4885ABL1 324/4885EGFR 599/4885
US-20150099736-A1 Indolyl-Pyridone Derivatives Having Checkpoint Kinase 1 Inhibitory Activity CHEK1, CHEK2, RAD1 PIK3CD 509/4885ABL1 111/4885EGFR 147/4885
US-10696652-B2 Indolyl-pyridone derivatives having checkpoint kinase 1 inhibitory activity CHEK2, CHEK1, BUB1B PIK3CD 460/4885ABL1 324/4885EGFR 599/4885
US-20020072526-A1 Orally active salts with tyrosine kinase activity TEK, FLT1, TIE1 PIK3CD 450/4885ABL1 78/4885EGFR 11/4885
US-20180244652-A1 Indolyl-Pyridone Derivatives Having Checkpoint Kinase 1 Inhibitory Activity CHEK2, CHEK1, BUB1B PIK3CD 460/4885ABL1 324/4885EGFR 599/4885

“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.