SCHEMBL25989348

SCHEMBL25989348

C[C@@](O)(c1ccc2ncc(-c3nc(N[C@@H]4CNC[C@H]4F)ccc3F)n2c1)C(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ FLT3 P36888 12/20 0.46
▸ NRAS P01111 5/20 0.43
▸ EIF2AK4 Q9P2K8 7/20 0.38
▸ IRAK4 Q9NWZ3 3/20 0.38
▸ IRAK1 P51617 1/20 0.34

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
SCHEMBL25993183 1.00 FLT3 (0.46) FLT3NRASEIF2AK4IRAK4IRAK1
SCHEMBL25989350 1.00 FLT3 (0.46) FLT3NRASEIF2AK4IRAK4IRAK1
SCHEMBL25998142 1.00 FLT3 (0.46) FLT3NRASEIF2AK4IRAK4IRAK1
SCHEMBL25992532 0.93 FLT3 (0.42) FLT3NRASEIF2AK4IRAK4IRAK1
SCHEMBL25988960 0.93 FLT3 (0.42) FLT3NRASEIF2AK4IRAK4IRAK1
SCHEMBL25988957 0.93 FLT3 (0.42) FLT3NRASEIF2AK4IRAK4IRAK1
SCHEMBL25998145 0.93 FLT3 (0.42) FLT3NRASEIF2AK4IRAK4IRAK1
SCHEMBL25990673 0.88 FLT3 (0.54) FLT3NRASEIF2AK4IRAK4
SCHEMBL25989345 0.88 FLT3 (0.54) FLT3NRASEIF2AK4IRAK4
SCHEMBL25989347 0.88 FLT3 (0.54) FLT3NRASEIF2AK4IRAK4

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
WO-2023150601-A2 MULTI-CYCLIC IRAK AND FLT3 INHIBITING COMPOUNDS AND USES THEREOF CHILDREN'S HOSPITAL MEDICAL CENTER (US) 2023-08-10 — — WO disclosed
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