SCHEMBL3774161

SCHEMBL3774161

Cc1ccnc(NC(=O)c2cn3cc(N(C)C)ccc3n2)c1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SORT1 Q99523 2/20 0.49
NPC1 O15118 10/20 0.46
RAB9A P51151 10/20 0.46
KMT2A Q03164 4/20 0.46
MEN1 O00255 2/20 0.46
POLB P06746 1/20 0.46
PKM P14618 3/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
LMNA P02545 1/20 0.43

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
SCHEMBL3778748 0.90 EGLN1 (0.42) SORT1
SCHEMBL3773352 0.87 GRM5 (0.43) NPC1RAB9A
SCHEMBL3771452 0.86 BRAF (0.47) SORT1
SCHEMBL3768038 0.85 LCK (0.49) SORT1NPC1RAB9AKMT2AMEN1
SCHEMBL3777392 0.85 NR4A2 (0.55) NPC1RAB9ASMN1; SMN2
SCHEMBL3780549 0.82 NR4A2 (0.42) NPC1RAB9A
SCHEMBL3777070 0.81 KDM4E (0.54) NPC1RAB9AKMT2AMEN1POLB
SCHEMBL3371180 0.80 KCNK3 (0.53) NPC1RAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL3766225 0.80 GRM5 (0.56) SORT1NPC1RAB9APOLBSMN1; SMN2
SCHEMBL3773122 0.80 SMN1; SMN2 (0.42) NPC1RAB9AKMT2APOLBSMN1; SMN2

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 SORT1 4733/4885NPC1 1267/4885RAB9A 1443/4885

“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.