SCHEMBL8234992

SCHEMBL8234992

O=C(Nc1ccc2[nH]ccc2c1)c1ccnc2[nH]c(-c3ccc(F)cc3)nc12

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.56
RAB9A P51151 4/20 0.56
GSK3B P49841 2/20 0.48
PRKCI P41743 1/20 0.47
ESR1 P03372 1/20 0.46
MAPT P10636 3/20 0.45
ATR Q13535 1/20 0.44
CFTR P13569 1/20 0.43
MET P08581 2/20 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
SCHEMBL4152760 0.85 VCP (0.53) NPC1RAB9AGSK3BMAPT
SCHEMBL4161624 0.85 GSK3B (0.52) NPC1RAB9AGSK3BMAPTMET
SCHEMBL4156506 0.82 GSK3B (0.52) NPC1RAB9AGSK3BMAPT
SCHEMBL8234683 0.82 NPC1 (0.54) NPC1RAB9AGSK3BCFTRMET
SCHEMBL4152144 0.81 GSK3B (0.60) NPC1RAB9AGSK3BMAPTATR
SCHEMBL4152806 0.81 GSK3B (0.57) GSK3BMAPTMET
SCHEMBL4161516 0.80 GSK3B (0.54) NPC1RAB9AGSK3BATR
SCHEMBL4152791 0.80 GSK3B (0.73) NPC1RAB9AGSK3BMET
SCHEMBL4152183 0.80 GSK3B (0.56) GSK3BMET
SCHEMBL4152885 0.80 MAPT (0.54) NPC1RAB9AGSK3BMAPT

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
US-20090170847-A1 Imidazopyridine Derivatives Inhibiting Protein Kinase Activity, Method for the Preparation Thereof and Pharmaceutical Composition Containing Same YUYU PHARMA, INC. (KR) 2009-07-02 US disclosed
US-20090170847-A1 Imidazopyridine Derivatives Inhibiting Protein Kinase Activity, Method for the Preparation Thereof and Pharmaceutical Composition Containing Same YUYU PHARMA, INC. (KR) 2009-07-02 US disclosed
WO-2007083978-A1 IMIDAZOPYRIDINE DERIVATIVES INHIBITING PROTEIN KINASE ACTIVITY, METHOD FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION CONTAINING SAME CRYSTALGENOMICS, INC. (KR) 2007-07-26 WO 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-20090170847-A1 Imidazopyridine Derivatives Inhibiting Protein Kinase Activity, Method for the Preparation Thereof and Pharmaceutical Composition Containing Same GSK3B, GSK3A, MAP3K3 NPC1 2497/4885RAB9A 2749/4885GSK3B 1/4885

“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.