SCHEMBL6518834

SCHEMBL6518834

CC(C)(O)c1cccc(-c2ccc3nc(-c4ccc(Cl)cc4)c(F)n3c2)c1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 1/20 0.61
KCNH2 Q12809 1/20 0.61
TOP2A P11388 1/20 0.49
CYP11B1 P15538 3/20 0.47
CYP11B2 P19099 3/20 0.47
SLC2A1 P11166 9/20 0.46
SLC2A2 P11168 1/20 0.44
TRPA1 O75762 2/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL6522276 0.89 NR4A2 (0.64) NR4A2KCNH2TOP2ACYP11B1CYP11B2
SCHEMBL6521664 0.88 NR4A2 (0.62) NR4A2KCNH2TOP2ACYP11B1CYP11B2
SCHEMBL6524887 0.80 NR4A2 (0.55) NR4A2KCNH2TOP2ACYP11B1CYP11B2
SCHEMBL6525040 0.79 CYP11B1 (0.54) NR4A2KCNH2TOP2ACYP11B1CYP11B2
SCHEMBL1472110 0.76 NR4A2 (1.00) NR4A2KCNH2CYP11B1CYP11B2SLC2A1
SCHEMBL3409155 0.75 CYP11B1 (0.49) NR4A2KCNH2CYP11B1CYP11B2SLC2A1
SCHEMBL6523043 0.74 CYP11B2 (0.54) NR4A2KCNH2CYP11B1CYP11B2SLC2A1
SCHEMBL3433254 0.72 NR4A2 (0.74) NR4A2KCNH2CYP11B1CYP11B2SLC2A1
SCHEMBL3409535 0.72 CYP11B1 (0.46) NR4A2KCNH2CYP11B1CYP11B2ALDH1A1
SCHEMBL3431737 0.71 NR4A2 (0.75) NR4A2KCNH2CYP11B1CYP11B2SLC2A1

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
EP-2262769-B1 POLYSUBSTITUTED 2-ARYL-6-PHENYL-IMIDAZO[1,2-A]PYRIDINE DERIVATIVES, AND PREPARATION AND THERAPEUTIC USE THEREOF SANOFI SA (FR) 2014-11-05 EP claimed
EP-2262769-B1 POLYSUBSTITUTED 2-ARYL-6-PHENYL-IMIDAZO[1,2-A]PYRIDINE DERIVATIVES, AND PREPARATION AND THERAPEUTIC USE THEREOF SANOFI SA (FR) 2014-11-05 EP disclosed
US-20110065745-A1 POLYSUBSTITUTED 2-ARYL-6-PHENYLIMIDAZO[1,2-A]PYRIDINE DERIVATIVES, AND PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2011-03-17 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-20110065745-A1 POLYSUBSTITUTED 2-ARYL-6-PHENYLIMIDAZO[1,2-A]PYRIDINE DERIVATIVES, AND PREPARATION AND THERAPEUTIC USE THEREOF JAK2, ABL1, REN NR4A2 1394/4885KCNH2 1641/4885TOP2A 1604/4885

“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.