SCHEMBL6838635

SCHEMBL6838635

Cc1cccc2c1nc(C(F)(F)F)c1nc(-c3ncc[nH]3)n(CCC3CCNCC3)c12

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPY1R P25929 2/20 0.37
JAK2 O60674 2/20 0.31
JAK1 P23458 2/20 0.31
TYK2 P29597 2/20 0.31
JAK3 P52333 2/20 0.31
ERN1 O75460 1/20 0.31
NR3C1 P04150 1/20 0.31
PARP1 P09874 1/20 0.31
PARP2 Q9UGN5 1/20 0.31
PARP14 Q460N5 1/20 0.30
STK4 Q13043 1/20 0.30
STK3 Q13188 1/20 0.30
SIK2 Q9H0K1 1/20 0.30
STK26 Q9P289 1/20 0.30
STK24 Q9Y6E0 1/20 0.30
SLC6A4 P31645 1/20 0.30
NCF1 P14598 1/20 0.30
MERTK Q12866 1/20 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
SCHEMBL6840099 0.88 NPY1R (0.37) NPY1RJAK2JAK1TYK2JAK3
SCHEMBL6840082 0.87 NCF1 (0.34) PARP1PARP2NCF1
SCHEMBL6838669 0.87 SSTR4 (0.37) SLC6A4
SCHEMBL6838649 0.86 NPY1R (0.38) NPY1RJAK2JAK1TYK2JAK3
SCHEMBL6837707 0.85 MERTK (0.37) NPY1RPARP1PARP2SLC6A4MERTK
SCHEMBL6838737 0.84 JAK2 (0.32) NPY1RJAK2JAK1TYK2JAK3
SCHEMBL6838673 0.84 NPY1R (0.36) NPY1RJAK2JAK1TYK2JAK3
SCHEMBL6833773 0.82 NPY1R (0.37) NPY1RJAK2JAK1TYK2JAK3
SCHEMBL6838709 0.82 CCR3 (0.33) NPY1RJAK2JAK1TYK2JAK3
SCHEMBL6838630 0.82 NPY1R (0.35) NPY1RPARP1PARP2PARP14SLC6A4

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-20040054182-A1 1h-imidazopyridine derivatives HOKURIKU SEIYAKU CO., LTD. (JP) 2004-03-18 US disclosed
EP-1256582-A1 1H-IMIDAZOPYRIDINE DERIVATIVES HOKURIKU SEIYAKU CO., LTD. (JP) 2002-11-13 EP 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-20040054182-A1 1h-imidazopyridine derivatives IL2, IL1A, IL4 NPY1R 1070/4885JAK2 30/4885JAK1 43/4885

“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.