SCHEMBL14765182

SCHEMBL14765182

CC1(C)OB(c2ccc3c(c2)-c2cc4ccccc4n2CCO3)OC1(C)C

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LPL P06858 4/20 0.39
LIPG Q9Y5X9 4/20 0.39
PIK3CA P42336 7/20 0.35
PIK3CB P42338 7/20 0.35
PIK3CG P48736 7/20 0.35
IRAK4 Q9NWZ3 1/20 0.34
ROCK1 Q13464 1/20 0.32
PIK3CD O00329 3/20 0.32
PRMT5 O14744 1/20 0.31
WDR77 Q9BQA1 1/20 0.31

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
SCHEMBL17522848 0.89 LPL (0.40) LPLLIPGIRAK4ROCK1PRMT5
SCHEMBL19609005 0.76 PIK3CA (0.39) PIK3CAPIK3CBPIK3CGPIK3CD
SCHEMBL14765173 0.76 PIK3CA (0.54) PIK3CAPIK3CBPIK3CGPIK3CD
SCHEMBL14764793 0.72 ROCK1 (0.36) LPLLIPGROCK1
SCHEMBL30003575 0.69 CYP11B1 (0.39) LPLLIPGROCK1
SCHEMBL13035958 0.69 CYP11B1 (0.39) LPLLIPGROCK1
SCHEMBL19608988 0.69 EGFR (0.39) PIK3CAPIK3CBPIK3CG
SCHEMBL14684514 0.68 MAOB (0.41) LPLLIPGPRMT5WDR77
SCHEMBL29634547 0.68 LPL (0.44) LPLLIPG
SCHEMBL14212260 0.68 LPL (0.44) LPLLIPG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2753325-B1 TETRACYCLIC HETEROCYCLE COMPOUNDS AND METHODS OF USE THEREOF FOR THE TREATMENT OF VIRAL DISEASES MERCK SHARP & DOHME (US) 2018-09-19 EP disclosed
US-9265773-B2 Tetracyclic heterocycle compounds and methods of use thereof for the treatment of viral diseases MERCK SHARP & DOHME CORP. (US) 2016-02-23 US disclosed
US-9265773-B2 Tetracyclic heterocycle compounds and methods of use thereof for the treatment of viral diseases MERCK SHARP & DOHME CORP. (US) 2016-02-23 US disclosed
US-9265773-B2 Tetracyclic heterocycle compounds and methods of use thereof for the treatment of viral diseases MERCK SHARP & DOHME CORP. (US) 2016-02-23 US disclosed
US-20140213571-A1 TETRACYCLIC HETEROCYCLE COMPOUNDS AND METHODS OF USE THEREOF FOR THE TREATMENT OF VIRAL DISEASES MERCK SHARP & DOHME LLC 2014-07-31 US disclosed
WO-2013033971-A1 TETRACYCLIC HETEROCYCLE COMPOUNDS AND METHODS OF USE THEREOF FOR THE TREATMENT OF VIRAL DISEASES MERCK SHARP & DOHME CORP. (US) 2013-03-14 WO disclosed
WO-2013033971-A1 TETRACYCLIC HETEROCYCLE COMPOUNDS AND METHODS OF USE THEREOF FOR THE TREATMENT OF VIRAL DISEASES MERCK SHARP & DOHME CORP. (US) 2013-03-14 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 (1 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-20140213571-A1 TETRACYCLIC HETEROCYCLE COMPOUNDS AND METHODS OF USE THEREOF FOR THE TREATMENT OF VIRAL DISEASES HCCS, HAVCR2, EIF2AK2 LPL 3214/4885LIPG 1993/4885PIK3CA 2953/4885

“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.