SCHEMBL4737518

SCHEMBL4737518

CC(C)(C)c1ccc(Cn2c(-c3c(Cl)cccc3-c3ccccc3)nc(O)cc2=O)cc1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EGLN3 Q9H6Z9 1/20 0.51
CCR9 P51686 8/20 0.42
NR1H4 Q96RI1 2/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
GAA P10253 1/20 0.40
HTT P42858 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
GPR55 Q9Y2T6 1/20 0.40
AGTR1 P30556 1/20 0.40
CCR2 P41597 1/20 0.39
SERPINE1 P05121 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPK1 P28482 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
SCHEMBL4739981 0.91 EGLN3 (0.56) EGLN3CCR9MEN1KMT2A
SCHEMBL5000326 0.86 CCR9 (0.47) EGLN3CCR9MEN1KMT2AGAA
SCHEMBL4740478 0.85 EGLN3 (0.45) EGLN3CCR9MEN1KMT2AGAA
SCHEMBL4741826 0.84 CCR2 (0.43) EGLN3MEN1KMT2AAGTR1CCR2
SCHEMBL4738470 0.83 LMNA (0.51) MEN1KMT2AHTTNPSR1CCR2
SCHEMBL4739209 0.83 EGLN3 (0.46) EGLN3CCR9MEN1KMT2A
SCHEMBL4741831 0.83 EGLN3 (0.48) EGLN3CCR9MEN1KMT2A
SCHEMBL4740088 0.82 CCR9 (0.45) EGLN3CCR9MEN1KMT2A
SCHEMBL4784822 0.81 MEN1 (0.45) EGLN3MEN1KMT2ACCR2ALDH1A1
SCHEMBL4740335 0.81 EGLN3 (0.46) EGLN3CCR9MEN1KMT2A

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 EGLN3 3/4885CCR9 4560/4885NR1H4 1509/4885

“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.