SCHEMBL1626748

SCHEMBL1626748

CCOC(=O)C(C(=O)OCC)C(=O)C(C)(C)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.46
POLB P06746 2/20 0.45
PPARG P37231 2/20 0.44
EPHX2 P34913 1/20 0.44
MAPT P10636 2/20 0.41
KDM4E B2RXH2 2/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
HSP90AA1 P07900 1/20 0.41
CRHBP P24387 1/20 0.41
CRHR2 Q13324 1/20 0.41
GAA P10253 1/20 0.41
ATM Q13315 1/20 0.40
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
IDH1 O75874 1/20 0.38
CES2 O00748 1/20 0.38
CES1 P23141 1/20 0.38
LMNA P02545 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
SCHEMBL1626934 0.88 MAPT (0.42) NPSR1POLBPPARGEPHX2MAPT
SCHEMBL1626434 0.87 AURKA (0.44) POLBMAPTKMT2AMEN1GAA
SCHEMBL1627104 0.85 ALDH1A1 (0.46) NPSR1POLBMAPTKDM4EKMT2A
SCHEMBL1626774 0.84 MAPT (0.42) NPSR1POLBMAPTKDM4EKMT2A
SCHEMBL1624647 0.84 CYP3A4 (0.48) POLBEPHX2MAPTKMT2AMEN1
SCHEMBL1627161 0.84 PIN1 (0.46) POLBMAPTKMT2AMEN1ALDH1A1
SCHEMBL1625483 0.81 AKR1C3 (0.38) NPSR1POLBALDH1A1HPGD
SCHEMBL3840713 0.78 CES2 (0.44) PPARGEPHX2ALDH1A1CES2CES1
SCHEMBL1625472 0.78 TSHR (0.43) NPSR1MAPTKDM4EKMT2AMEN1
SCHEMBL22458448 0.78 NPSR1 (0.48) NPSR1POLBPPARGEPHX2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7928139-B2 Naphthalenone compounds exhibiting prolyl hydroxylase inhibitory activity, compositions, and uses thereof AMGEN INC. (US) 2011-04-19 US disclosed
US-20100048572-A1 NAPHTHALENONE COMPOUNDS EXHIBITING PROLYL HYDROXYLASE INHIBITORY ACTIVITY, COMPOSITIONS, AND USES THEREOF AMGEN INC. (US) 2010-02-25 US disclosed
US-7635715-B2 Naphthalenone compounds exhibiting prolyl hydroxylase inhibitory activity, compositions, and uses thereof AMGEN INC. (US) 2009-12-22 US disclosed
US-20090093483-A1 Naphthalenone compounds exhibiting prolyl hydroxylase inhibitory activity, compositions, and uses thereof AMGEN INC. (US) 2009-04-09 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 (2 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-20100048572-A1 NAPHTHALENONE COMPOUNDS EXHIBITING PROLYL HYDROXYLASE INHIBITORY ACTIVITY, COMPOSITIONS, AND USES THEREOF EGLN2, EGLN3, HIF1AN NPSR1 1689/4885POLB 1066/4885PPARG 570/4885
US-20090093483-A1 Naphthalenone compounds exhibiting prolyl hydroxylase inhibitory activity, compositions, and uses thereof EGLN2, EGLN3, HIF1AN NPSR1 1689/4885POLB 1066/4885PPARG 570/4885

“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.