SCHEMBL26109211

SCHEMBL26109211

Cn1c(C2=CCC3(CC2)CCN(C=CC=O)CC3)c(-c2cnc(OC3CC3)c(F)c2)c2c(N)ncnc21

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 1/20 0.33
▸ BTK Q06187 1/20 0.32
▸ FGFR1 P11362 2/20 0.31
▸ FGFR2 P21802 2/20 0.31
▸ FGFR4 P22455 2/20 0.31
▸ FGFR3 P22607 2/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ CYP2D6 P10635 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ CYP2C19 P33261 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
SCHEMBL26109533 0.92 KIT (0.35) PIK3CDFGFR1FGFR2FGFR4FGFR3
SCHEMBL26108721 0.86 KCNH2 (0.33) BTK
SCHEMBL30582505 0.86 BTK (0.41) PIK3CDBTKFGFR1FGFR2FGFR4
SCHEMBL26109846 0.86 KCNH2 (0.36) BTK
SCHEMBL26109178 0.85 FGFR1 (0.31) FGFR1FGFR2FGFR4FGFR3
SCHEMBL26108434 0.85 KCNH2 (0.30) —
SCHEMBL26108662 0.84 FLT3 (0.34) BTK
SCHEMBL26109064 0.84 FLT3 (0.34) BTK
SCHEMBL26109006 0.83 RIPK2 (0.35) PIK3CDFGFR1FGFR2FGFR4FGFR3
SCHEMBL26108781 0.83 BTK (0.35) BTKFGFR1FGFR2FGFR4FGFR3

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
WO-2023192502-A1 SPIROBICYCLIC COMPOUNDS ACERAND THERAPEUTICS (USA) LIMITED (US) 2023-10-05 — — WO claimed
WO-2023192502-A1 SPIROBICYCLIC COMPOUNDS ACERAND THERAPEUTICS (USA) LIMITED (US) 2023-10-05 — — WO disclosed
Send feedback