SCHEMBL24933928

SCHEMBL24933928

Cc1nn(C(=O)OC(C)(C)C)c2cnc(Cl)cc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRG2 P18507 3/20 0.37
GABRB3 P28472 3/20 0.37
GABRA5 P31644 3/20 0.37
CHRM4 P08173 2/20 0.36
GABRA1 P14867 2/20 0.35
GABRA2 P47869 1/20 0.35
GABRA6 Q16445 1/20 0.35
FAAH O00519 1/20 0.35
MAP2K4 P45985 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.34
HSP90AA1 P07900 1/20 0.33
HSP90AB1 P08238 1/20 0.33
CCR9 P51686 2/20 0.33
POLB P06746 1/20 0.33
AAK1 Q2M2I8 1/20 0.32
ELANE P08246 1/20 0.32
SLC22A12 Q96S37 1/20 0.32
PTGER1 P34995 1/20 0.31
NPC1 O15118 1/20 0.31
LMNA P02545 1/20 0.31

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
SCHEMBL19965548 0.86 GABRG2 (0.41) GABRG2GABRB3GABRA5GABRA1GABRA2
SCHEMBL19960725 0.86 GABRG2 (0.41) GABRG2GABRB3GABRA5GABRA1GABRA2
SCHEMBL31425540 0.85 GABRG2 (0.36) GABRG2GABRB3GABRA5GABRA1GABRA2
SCHEMBL14688976 0.84 GABRG2 (0.37) GABRG2GABRB3GABRA5GABRA1GABRA2
SCHEMBL31425526 0.81 ELANE (0.35) GABRG2GABRB3GABRA5FAAHPTGDR2
SCHEMBL19965543 0.79 MAP2K4 (0.41) GABRG2GABRB3GABRA5MAP2K4
SCHEMBL21509829 0.78 AAK1 (0.44) MAP2K4HSP90AA1HSP90AB1AAK1
SCHEMBL19950249 0.78 TTK (0.42) MAP2K4
SCHEMBL29746390 0.78 TTK (0.42) MAP2K4
SCHEMBL20804451 0.78 FAAH (0.35) GABRG2GABRB3GABRA5FAAHMAP2K4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4119558-A1 PYRAZOLOPYRIDINE COMPOUNDS AND USES THEREOF Incyte Corporation (US) 2023-01-18 EP disclosed