SCHEMBL4742595

SCHEMBL4742595

CC(C)(C)c1ccc(Cn2c(-c3cc(Cl)ccc3Cl)nc(O)cc2=O)cc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CCR9 P51686 12/20 0.49
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
PTGES2 Q9H7Z7 1/20 0.41
MDM2 Q00987 1/20 0.40
EGLN3 Q9H6Z9 1/20 0.39
KDM4E B2RXH2 2/20 0.39
LMNA P02545 1/20 0.37
HTT P42858 1/20 0.37
KCNH2 Q12809 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CCR2 P41597 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37

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
SCHEMBL4741831 0.85 EGLN3 (0.48) CCR9MEN1KMT2APTGES2EGLN3
SCHEMBL4740478 0.83 EGLN3 (0.45) CCR9MEN1KMT2AEGLN3KDM4E
SCHEMBL4739981 0.82 EGLN3 (0.56) CCR9MEN1KMT2AEGLN3SMN1; SMN2
SCHEMBL4740088 0.82 CCR9 (0.45) CCR9MEN1KMT2APTGES2EGLN3
SCHEMBL4740335 0.81 EGLN3 (0.46) CCR9MEN1KMT2APTGES2EGLN3
SCHEMBL4739127 0.80 KMT2A (0.44) CCR9MEN1KMT2AEGLN3SMN1; SMN2
SCHEMBL4739991 0.80 CCR9 (0.49) CCR9MEN1KMT2AEGLN3KDM4E
SCHEMBL5000326 0.79 CCR9 (0.47) CCR9MEN1KMT2AEGLN3LMNA
SCHEMBL4740385 0.79 CCR9 (0.45) CCR9MEN1KMT2A
SCHEMBL4736971 0.79 EGLN3 (0.45) CCR9MEN1KMT2AEGLN3CCR2

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 4560/4885MEN1 2935/4885KMT2A 734/4885

“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.