SCHEMBL31416745

SCHEMBL31416745

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

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.36
PIK3CA P42336 1/20 0.36
PIK3CB P42338 1/20 0.36
PI4KA P42356 1/20 0.36
PIK3CG P48736 1/20 0.36
PI4KB Q9UBF8 1/20 0.36
HDAC6 Q9UBN7 3/20 0.36
NPSR1 Q6W5P4 3/20 0.35
RXFP1 Q9HBX9 1/20 0.35
PDE10A Q9Y233 2/20 0.35
ALDH1A1 P00352 1/20 0.34
LMNA P02545 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
GAA P10253 1/20 0.34
HTT P42858 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
HSD11B1 P28845 1/20 0.34
CYP2C19 P33261 1/20 0.34
LIPC P11150 2/20 0.33

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
SCHEMBL31416730 0.88 PIK3CD (0.45) PIK3CDPIK3CAPIK3CBPI4KAPIK3CG
SCHEMBL31416814 0.84 KMT2A (0.44) NPSR1RXFP1ALDH1A1LMNASMN1; SMN2
SCHEMBL31416796 0.74 LRRK2 (0.38) PIK3CAPIK3CBPIK3CGALDH1A1GAA
SCHEMBL31416779 0.70 PIK3CD (0.34) PIK3CDPIK3CAPIK3CBPI4KAPIK3CG
SCHEMBL34469948 0.69 PDE10A (0.38) PIK3CDPIK3CAPIK3CBPI4KAPIK3CG
SCHEMBL31416713 0.69 ADORA3 (0.36) PIK3CDPIK3CAPIK3CBPI4KAPIK3CG
SCHEMBL34469724 0.68 KDM4E (0.40) PIK3CDPIK3CAPIK3CBPI4KAPIK3CG
SCHEMBL23617959 0.66 CYP2C19 (0.45) HDAC6PDE10AALDH1A1CYP3A4CYP2C9
SCHEMBL34470098 0.65 GAA (0.40) HDAC6NPSR1PDE10AALDH1A1LMNA
SCHEMBL18656031 0.65 PTPN5 (0.41) HDAC6PDE10AALDH1A1CYP3A4CYP2C9

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