SCHEMBL4740385

SCHEMBL4740385

CC(C)(C)c1ccc(Cn2c(-c3ccncc3)nc(O)cc2=O)cc1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CCR9 P51686 10/20 0.45
PDE5A O76074 1/20 0.43
RIPK3 Q9Y572 1/20 0.43
RHEB Q15382 1/20 0.42
KIF11 P52732 1/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
IDO1 P14902 1/20 0.40
GSK3B P49841 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
RECQL P46063 1/20 0.39
HSD17B10 Q99714 1/20 0.39
METAP2 P50579 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
SCHEMBL5000326 0.90 CCR9 (0.47) CCR9KMT2AMEN1ALDH1A1RECQL
SCHEMBL4741837 0.85 CCR9 (0.42) CCR9PDE5AKMT2AMEN1ALDH1A1
SCHEMBL4739991 0.83 CCR9 (0.49) CCR9KMT2AMEN1METAP2
SCHEMBL4740335 0.82 EGLN3 (0.46) CCR9RIPK3KMT2AMEN1
SCHEMBL4739209 0.82 EGLN3 (0.46) CCR9KMT2AMEN1METAP2
SCHEMBL4741831 0.82 EGLN3 (0.48) CCR9KMT2AMEN1
SCHEMBL4740088 0.81 CCR9 (0.45) CCR9KMT2AMEN1
SCHEMBL4739981 0.81 EGLN3 (0.56) CCR9KMT2AMEN1METAP2
SCHEMBL4737534 0.80 EGLN3 (0.44) CCR9RIPK3KMT2AMEN1METAP2
SCHEMBL4741832 0.80 CCR9 (0.44) CCR9KMT2AMEN1METAP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008089051-A1 N-SUBSTITUTED GLYCINE DERIVATIVES: PROLYL HYDROXYLASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2008-07-24 WO disclosed
US-20080171756-A1 N-Substituted Glycine Derivatives: Prolyl Hydroxylase Inhibitors SMITHKLINE BEECHAM CORPORATION 2008-07-17 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 (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-20080171756-A1 N-Substituted Glycine Derivatives: Prolyl Hydroxylase Inhibitors HIF1AN, EGLN2, EGLN3 CCR9 4560/4885PDE5A 1915/4885RIPK3 3729/4885

“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.