SCHEMBL31416730

SCHEMBL31416730

CC(=O)c1sc(N)nc1-c1ccn(CC(F)(F)F)c(=O)c1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 3/20 0.45
PIK3CA P42336 3/20 0.45
PI4KA P42356 3/20 0.45
PI4KB Q9UBF8 3/20 0.45
PIK3CG P48736 2/20 0.45
PIK3CB P42338 2/20 0.45
RORB Q92753 13/20 0.39
ALDH1A1 P00352 1/20 0.37
HSD17B10 Q99714 1/20 0.37
RORC P51449 2/20 0.37
PDE10A Q9Y233 2/20 0.35

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
SCHEMBL31416745 0.88 PIK3CD (0.36) PIK3CDPIK3CAPI4KAPI4KBPIK3CG
SCHEMBL31416814 0.83 KMT2A (0.44) ALDH1A1RORC
SCHEMBL31416726 0.74 LRRK2 (0.38) PIK3CDPIK3CAPI4KAPI4KBPIK3CG
SCHEMBL31416779 0.71 PIK3CD (0.34) PIK3CDPIK3CAPI4KAPI4KBPIK3CG
SCHEMBL34469948 0.70 PDE10A (0.38) PIK3CDPIK3CAPI4KAPI4KBPIK3CG
SCHEMBL31416713 0.68 ADORA3 (0.36) PIK3CDPIK3CAPI4KAPI4KBPIK3CG
SCHEMBL330400 0.68 ALDH1A1 (0.65) RORBALDH1A1HSD17B10
SCHEMBL34469724 0.67 KDM4E (0.40) PIK3CDPIK3CAPI4KAPI4KBPIK3CG
SCHEMBL7952618 0.66 SMN1; SMN2 (0.42) PIK3CDPIK3CAPI4KAPI4KBPIK3CG
SCHEMBL1256374 0.66 ALDH1A1 (0.54) PIK3CDPIK3CAPI4KAPI4KBPIK3CG

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
EP-4746964-A1 NEW PYRAZOLOPYRIDINE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2026-05-27 EP disclosed
WO-2025017078-A1 NEW PYRAZOLOPYRIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2025-01-23 WO disclosed