SCHEMBL17336535

SCHEMBL17336535

CC(C)(C)OC(=O)n1ccc2cc(F)ncc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 3/20 0.48
PIK3CD O00329 2/20 0.48
ABL1 P00519 2/20 0.48
EGFR P00533 2/20 0.48
HCK P08631 2/20 0.48
SRC P12931 2/20 0.48
KDR P35968 2/20 0.48
PIK3CB P42338 2/20 0.48
MTOR P42345 2/20 0.48
PIK3CG P48736 2/20 0.48
EPHB4 P54760 2/20 0.48
PRKDC P78527 2/20 0.48
PI4KB Q9UBF8 2/20 0.48
HSP90AA1 P07900 1/20 0.41
HSP90AB1 P08238 1/20 0.41
MAPT P10636 2/20 0.40
GABRG2 P18507 2/20 0.38
GABRB3 P28472 2/20 0.38
GABRA5 P31644 2/20 0.38
ACLY P53396 1/20 0.38

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
SCHEMBL17847214 0.85 PIK3CA (0.47) PIK3CAPIK3CDABL1EGFRHCK
SCHEMBL30670478 0.85 PIK3CA (0.47) PIK3CAPIK3CDABL1EGFRHCK
SCHEMBL15091426 0.84 PIK3CA (0.46) PIK3CAPIK3CDABL1EGFRHCK
SCHEMBL1396849 0.84 PIK3CD (0.48) PIK3CAPIK3CDABL1EGFRHCK
SCHEMBL30918924 0.83 PIK3CA (0.45) PIK3CAPIK3CDABL1EGFRHCK
SCHEMBL15091891 0.83 PIK3CA (0.45) PIK3CAPIK3CDABL1EGFRHCK
SCHEMBL26498723 0.83 PIK3CA (0.45) PIK3CAPIK3CDABL1EGFRHCK
SCHEMBL17583735 0.83 PIK3CA (0.45) PIK3CAPIK3CDABL1EGFRHCK
SCHEMBL17859395 0.83 PIK3CB (0.45) PIK3CAPIK3CDABL1EGFRHCK
SCHEMBL21920779 0.81 PIK3CD (0.44) PIK3CAPIK3CDABL1EGFRHCK

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
US-10570149-B2 Tricyclic heterocylic derivatives MERCK PATENT GMBH (DE) 2020-02-25 US disclosed
EP-3464295-B1 TRICYCLIC HETEROCYLIC DERIVATIVES MERCK PATENT GMBH (DE) 2020-02-05 EP disclosed
EP-3154970-B1 PYRROLO[2,3-C]PYRIDINES AS IMAGING AGENTS FOR NEUROFIBRILARY TANGLES MERCK SHARP & DOHME (US) 2019-11-06 EP disclosed
EP-3154970-B1 PYRROLO[2,3-C]PYRIDINES AS IMAGING AGENTS FOR NEUROFIBRILARY TANGLES MERCK SHARP & DOHME (US) 2019-11-06 EP disclosed
US-20190300547-A1 TRICYCLIC HETEROCYLIC DERIVATIVES MERCK PATENT GMBH (DE) 2019-10-03 US disclosed
US-10022461-B2 Pyrrolo[2,3-C]pyridines as imaging agents for neurofibrilary tangles MERCK SHARP & DOHME CORP. (US) 2018-07-17 US disclosed
US-10022461-B2 Pyrrolo[2,3-C]pyridines as imaging agents for neurofibrilary tangles MERCK SHARP & DOHME CORP. (US) 2018-07-17 US disclosed
US-10022461-B2 Pyrrolo[2,3-C]pyridines as imaging agents for neurofibrilary tangles MERCK SHARP & DOHME CORP. (US) 2018-07-17 US disclosed
US-20180071412-A1 PYRROLO[2,3-C]PYRIDINES AS IMAGING AGENTS FOR NEUROFIBRILARY TANGLES MERCK SHARP & DOHME CORP. (US) 2018-03-15 US disclosed
US-20180071412-A1 PYRROLO[2,3-C]PYRIDINES AS IMAGING AGENTS FOR NEUROFIBRILARY TANGLES MERCK SHARP & DOHME CORP. (US) 2018-03-15 US disclosed
US-9808542-B2 Pyrrolo[2,3-C]pyridines as imaging agents for neurofibrillary MERCK SHARP & DOHME CORP. (US) 2017-11-07 US disclosed
US-9808542-B2 Pyrrolo[2,3-C]pyridines as imaging agents for neurofibrillary MERCK SHARP & DOHME CORP. (US) 2017-11-07 US disclosed
US-20170119912-A1 PYRROLO[2,3-C]PYRIDINES AS IMAGING AGENTS FOR NEUROFIBRILLARY MERCK SHARP & DOHME CORP. (US) 2017-05-04 US disclosed
US-20170119912-A1 PYRROLO[2,3-C]PYRIDINES AS IMAGING AGENTS FOR NEUROFIBRILLARY MERCK SHARP & DOHME CORP. (US) 2017-05-04 US disclosed
US-20170119912-A1 PYRROLO[2,3-C]PYRIDINES AS IMAGING AGENTS FOR NEUROFIBRILLARY MERCK SHARP & DOHME CORP. (US) 2017-05-04 US disclosed
EP-3154970-A2 PYRROLO[2,3-C]PYRIDINES AS IMAGING AGENTS FOR NEUROFIBRILARY TANGLES Merck Sharp & Dohme Corp. (US) 2017-04-19 EP disclosed
WO-2015191506-A2 PYRROLO[2,3-C]PYRIDINES AS IMAGING AGENTS FOR NEUROFIBRILARY TANGLES MERCK SHARP & DOHME CORP. (US) 2015-12-17 WO disclosed
WO-2015188368-A1 PYRROLO[2,3-C]PYRIDINES AS IMAGING AGENTS FOR NEUROFIBRILARY TANGLES MERCK SHARP & DOHME CORP. (US) 2015-12-17 WO disclosed
WO-2015188368-A1 PYRROLO[2,3-C]PYRIDINES AS IMAGING AGENTS FOR NEUROFIBRILARY TANGLES MERCK SHARP & DOHME CORP. (US) 2015-12-17 WO disclosed
WO-2015191506-A2 PYRROLO[2,3-C]PYRIDINES AS IMAGING AGENTS FOR NEUROFIBRILARY TANGLES MERCK SHARP & DOHME CORP. (US) 2015-12-17 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 (5 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-10022461-B2 Pyrrolo[2,3-C]pyridines as imaging agents for neurofibrilary tangles MAPT, SNCA, PARK7 PIK3CA 2844/4885PIK3CD 2474/4885ABL1 1429/4885
US-20190300547-A1 TRICYCLIC HETEROCYLIC DERIVATIVES ATR, TTI1, CDK1 PIK3CA 2107/4885PIK3CD 2757/4885ABL1 494/4885
US-20170119912-A1 PYRROLO[2,3-C]PYRIDINES AS IMAGING AGENTS FOR NEUROFIBRILLARY MAPT, SNCA, PARK7 PIK3CA 3031/4885PIK3CD 2539/4885ABL1 2401/4885
US-20180071412-A1 PYRROLO[2,3-C]PYRIDINES AS IMAGING AGENTS FOR NEUROFIBRILARY TANGLES MAPT, SNCA, PARK7 PIK3CA 2844/4885PIK3CD 2474/4885ABL1 1429/4885
US-10570149-B2 Tricyclic heterocylic derivatives ATR, TTI1, CDK1 PIK3CA 2107/4885PIK3CD 2757/4885ABL1 494/4885

“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.