SCHEMBL214864

SCHEMBL214864

Cc1ccc(Br)cc1-n1cnc(C(N)=O)c1C(=O)Nc1[nH]nc(Cl)c1C

nearest known ligand 0.32

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 3/20 0.32
JAK1 P23458 2/20 0.32
TYK2 P29597 1/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31
GABRG2 P18507 2/20 0.30
GABRB3 P28472 2/20 0.30
GABRA5 P31644 2/20 0.30
ATM Q13315 1/20 0.30
GABRA1 P14867 1/20 0.30
GABRA3 P34903 1/20 0.30
GABRA2 P47869 1/20 0.30
GABRA6 Q16445 1/20 0.30
HCAR1 Q9BXC0 2/20 0.30

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
SCHEMBL214660 0.84 SIK1 (0.33) JAK2JAK1TYK2MEN1RAB9A
SCHEMBL215407 0.82 MTOR (0.38) MEN1NPC1RAB9AKMT2AGABRG2
SCHEMBL215228 0.82 SCN9A (0.44) JAK2MEN1NPC1RAB9AKMT2A
SCHEMBL214574 0.80 RAB9A (0.41) MEN1NPC1RAB9AKMT2A
SCHEMBL215824 0.79 RAB9A (0.41) MEN1NPC1RAB9AKMT2A
SCHEMBL213975 0.79 KMT2A (0.42) MEN1NPC1RAB9AKMT2A
SCHEMBL215330 0.79 ALDH1A1 (0.46) MEN1NPC1RAB9AKMT2A
SCHEMBL215860 0.78 MEN1 (0.38) MEN1NPC1RAB9AKMT2A
SCHEMBL213991 0.77 GABRG2 (0.31) JAK2JAK1TYK2GABRG2GABRB3
SCHEMBL213884 0.77 HCAR1 (0.33) MEN1NPC1RAB9AKMT2AGABRG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8088767-B2 JAK-2 modulators and methods of use EXELIXIS, INC. (US) 2012-01-03 US disclosed
US-20100136136-A1 JAK-2 Modulators and Methods of Use EXELIXIS, INC. (US) 2010-06-03 US disclosed
EP-2061768-A2 IMIDAZOLE-4,5-DICARBOXAMIDE DERIVATIVES AS JAK-2 MODULATORS Exelixis, Inc. (US) 2009-05-27 EP disclosed
WO-2008042282-A2 IMIDAZOLE-4, 5-DICARBOXAMIDE DERIVATIVES AS JAK-2 MODULATORS EXELIXIS, INC. (US) 2008-04-10 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-20100136136-A1 JAK-2 Modulators and Methods of Use JAK2, JAK1, JAK3 JAK2 1/4885JAK1 2/4885TYK2 4/4885

“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.