SCHEMBL3774757

SCHEMBL3774757

N#Cc1ccnc(NC(=O)c2cn3cc(-c4cccc(CO)c4)ccc3n2)c1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 3/20 0.51
CYP2C9 P11712 2/20 0.51
KCNH2 Q12809 1/20 0.51
EGLN1 Q9GZT9 6/20 0.47
GRM5 P41594 1/20 0.46
ALDH1A3 P47895 1/20 0.44
USP30 Q70CQ3 1/20 0.41

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
SCHEMBL3780533 0.88 NR4A2 (0.59) NR4A2CYP2C9KCNH2EGLN1
SCHEMBL3774017 0.88 NR4A2 (0.53) NR4A2CYP2C9KCNH2EGLN1
SCHEMBL2432828 0.87 CYP2C9 (0.50) NR4A2CYP2C9KCNH2EGLN1ALDH1A3
SCHEMBL3771461 0.86 NR4A2 (0.58) NR4A2CYP2C9KCNH2EGLN1
Hydrochloric Acid SCHEMBL3778778 0.85 NR4A2 (0.57) NR4A2CYP2C9KCNH2EGLN1
SCHEMBL2435156 0.82 EGLN1 (0.50) NR4A2CYP2C9KCNH2EGLN1ALDH1A3
SCHEMBL3781014 0.81 NR4A2 (0.54) NR4A2CYP2C9KCNH2EGLN1
SCHEMBL3766442 0.80 NR4A2 (0.55) NR4A2CYP2C9KCNH2EGLN1GRM5
SCHEMBL3368804 0.80 NR4A2 (0.60) NR4A2CYP2C9KCNH2EGLN1
SCHEMBL3771134 0.79 NR4A2 (0.54) NR4A2CYP2C9KCNH2EGLN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100317673-A1 N-HETEROCYCLIC-IMIDAZO[1,2-a]PYRIDINE-2-CARBOXAMIDE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI-AVENTIS (FR) 2010-12-16 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 (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-20100317673-A1 N-HETEROCYCLIC-IMIDAZO[1,2-a]PYRIDINE-2-CARBOXAMIDE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION IDH2, GLS, IDH1 NR4A2 1193/4885CYP2C9 1454/4885KCNH2 337/4885

“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.