SCHEMBL3778748

SCHEMBL3778748

CN(C)c1ccc2nc(C(=O)Nc3cc(Cl)ccn3)cn2c1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 3/20 0.42
FGFR4 P22455 1/20 0.42
NR4A2 P43354 2/20 0.41
CYP2C9 P11712 1/20 0.41
SORT1 Q99523 1/20 0.40
GRM5 P41594 2/20 0.40
APP P05067 1/20 0.40
MAP3K5 Q99683 1/20 0.40
GSK3A P49840 1/20 0.38
MAPK10 P53779 1/20 0.38
RIOK2 Q9BVS4 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
SCHEMBL3774161 0.90 SORT1 (0.49) SORT1
SCHEMBL3773352 0.86 GRM5 (0.43) NR4A2CYP2C9GRM5APP
SCHEMBL3771452 0.85 BRAF (0.47) NR4A2SORT1GRM5RIOK2
SCHEMBL3777392 0.84 NR4A2 (0.55) NR4A2CYP2C9GRM5
SCHEMBL3365500 0.81 NPC1 (0.55) EGLN1NR4A2CYP2C9
SCHEMBL3367620 0.80 APP (0.45) EGLN1APP
SCHEMBL3780549 0.79 NR4A2 (0.42) EGLN1NR4A2CYP2C9MAP3K5
SCHEMBL3768038 0.79 LCK (0.49) EGLN1SORT1
SCHEMBL3773122 0.79 SMN1; SMN2 (0.42) EGLN1NR4A2CYP2C9APP
SCHEMBL3777070 0.78 KDM4E (0.54)

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
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
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 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-20100317673-A1 N-HETEROCYCLIC-IMIDAZO[1,2-a]PYRIDINE-2-CARBOXAMIDE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION IDH2, GLS, IDH1 EGLN1 2168/4885FGFR4 3358/4885NR4A2 1193/4885

“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.