SCHEMBL29273677

SCHEMBL29273677

CN1CCC(n2cc(Oc3cc(B4OC(C)(C)C(C)(C)O4)cnc3N)cn2)CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 2/20 0.39
FGFR1 P11362 4/20 0.38
FGFR2 P21802 4/20 0.38
FGFR3 P22607 4/20 0.38
BMPR1A P36894 1/20 0.37
ACVRL1 P37023 1/20 0.37
ACVR1 Q04771 1/20 0.37
NTRK1 P04629 2/20 0.35
MAP4K3 Q8IVH8 4/20 0.35
EGFR P00533 2/20 0.35
AXL P30530 2/20 0.33
MAP3K7 O43318 1/20 0.33
TAB1 Q15750 1/20 0.33
MERTK Q12866 1/20 0.33
IKBKE Q14164 1/20 0.33
TBK1 Q9UHD2 1/20 0.33
JAK2 O60674 1/20 0.33
PIK3CD O00329 1/20 0.32
IRAK1 P51617 1/20 0.32
NTRK3 Q16288 1/20 0.32

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
SCHEMBL24270161 0.81 MET (0.39) METFGFR1FGFR2FGFR3BMPR1A
SCHEMBL30935008 0.79 FGFR1 (0.42) METFGFR1FGFR2FGFR3BMPR1A
SCHEMBL29273539 0.79 FGFR1 (0.42) METFGFR1FGFR2FGFR3BMPR1A
SCHEMBL29273569 0.77 PDGFRB (0.35) METFGFR1FGFR2FGFR3
SCHEMBL657486 0.76 FFAR1 (0.44) METBMPR1AACVRL1ACVR1NTRK1
SCHEMBL31276752 0.71 DYRK1A (0.44) METNTRK1
SCHEMBL29547825 0.70 FGFR3 (0.41) METFGFR1FGFR2FGFR3BMPR1A
SCHEMBL23022232 0.70 MET (0.41) METFGFR1FGFR2FGFR3BMPR1A
SCHEMBL21426239 0.70 FFAR1 (0.42) IRAK4
SCHEMBL21588639 0.69 FFAR1 (0.40) NTRK1IKBKETBK1PIK3CDIRAK1

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
CN-118344342-A Substituted polyaromatic ring derivatives, compositions and uses thereof 康迈迪森(北京)医药科技有限公司 2024-07-16 CN disclosed