SCHEMBL1011925

SCHEMBL1011925

COC(=O)[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1CCc1ccc2ccccc2c1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 3/20 0.47
TACR1 P25103 3/20 0.43
NAMPT P43490 1/20 0.40
PPARG P37231 6/20 0.39
PPARA Q07869 6/20 0.39
ADAM17 P78536 1/20 0.39

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
SCHEMBL1013992 0.90 PPARG (0.47) PDE4BTACR1NAMPTPPARGPPARA
SCHEMBL1013868 0.87 PDE4B (0.49) PDE4BTACR1NAMPT
SCHEMBL1014461 0.82 ACHE (0.45) PDE4BTACR1NAMPTADAM17
SCHEMBL22160551 0.81 TACR1 (0.49) TACR1NAMPTADAM17
SCHEMBL22160548 0.81 TACR1 (0.49) TACR1NAMPTADAM17
SCHEMBL22160546 0.81 TACR1 (0.49) TACR1NAMPTADAM17
SCHEMBL23951471 0.79 PDE4B (0.51) PDE4BTACR1NAMPT
SCHEMBL2935226 0.77 PPARG (0.48) PDE4BTACR1NAMPTPPARGPPARA
SCHEMBL1014375 0.77 PPARG (0.48) PDE4BTACR1NAMPTPPARGPPARA
SCHEMBL2934939 0.77 PPARG (0.47) TACR1NAMPTPPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2272858-A2 HCV inhibitors comprising beta amino acids and their uses Novartis AG (CH) 2011-01-12 EP disclosed
EP-2007787-A2 HCV INHIBITORS COMPRISING BETA AMINO ACIDS AND THEIR USES Novartis AG (CH) 2008-12-31 EP disclosed
US-20080045530-A1 Organic Compounds and Their Uses BRANDL TRIXI 2008-02-21 US disclosed
US-20080045530-A1 Organic Compounds and Their Uses BRANDL TRIXI 2008-02-21 US disclosed
US-20080045530-A1 Organic Compounds and Their Uses BRANDL TRIXI 2008-02-21 US disclosed
WO-2007121124-A2 HCV INHIBITORS COMPRISING BETA AMINO ACIDS AND THEIR USES NOVARTIS AG (CH) 2007-10-25 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-20080045530-A1 Organic Compounds and Their Uses OAT, OTC, AOX1 PDE4B 3578/4885TACR1 2139/4885NAMPT 1593/4885

“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.