SCHEMBL3484713

SCHEMBL3484713

CN(C)C(=O)CNc1ncc(-c2cccc(C(F)(F)F)c2)cc1O

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 18/20 0.55
GRIN1 Q05586 12/20 0.54
PARP1 P09874 1/20 0.43
ALDH1A1 P00352 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL3485009 0.86 GRIN2B (0.53) GRIN2B
SCHEMBL3485004 0.86 GRIN2B (0.53) GRIN2BGRIN1PARP1ALDH1A1L3MBTL1
SCHEMBL3484822 0.85 GRIN2B (0.52) GRIN2BGRIN1PARP1
SCHEMBL3045422 0.83 EGLN1 (0.53) GRIN2BGRIN1
SCHEMBL31731759 0.83 EGLN1 (0.53) GRIN2BGRIN1
SCHEMBL3484710 0.83 EGLN1 (0.57) GRIN2BGRIN1
SCHEMBL3485355 0.80 GRIN2B (0.48) GRIN2BGRIN1PARP1
SCHEMBL3485270 0.80 GRIN2B (0.47) GRIN2BGRIN1PARP1ALDH1A1
SCHEMBL14331171 0.79 GRIN2B (0.51) GRIN2B
SCHEMBL3485426 0.76 PARP1 (0.50) GRIN2BGRIN1PARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160009648-A1 PROLYL HYDROXYLASE INHIBITORS AND METHODS OF USE KREOS CAPITAL VII (UK) LIMITED (GB) 2016-01-14 US claimed
US-8343952-B2 Prolyl hydroxylase inhibitors and methods of use AKEBIA THERAPEUTICS INC. (US) 2013-01-01 US claimed
US-20100331303-A1 PROLYL HYDROXYLASE INHIBITORS AND METHODS OF USE AKEBIA THERAPEUTICS, INC. 2010-12-30 US claimed

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-20160009648-A1 PROLYL HYDROXYLASE INHIBITORS AND METHODS OF USE HIF1AN, EGLN3, HIF1A GRIN2B 4440/4885GRIN1 4305/4885PARP1 184/4885
US-20100331303-A1 PROLYL HYDROXYLASE INHIBITORS AND METHODS OF USE HIF1AN, EGLN3, HIF1A GRIN2B 4440/4885GRIN1 4305/4885PARP1 184/4885

“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.