SCHEMBL25048945

SCHEMBL25048945

CC(C)(C)OC(=O)N1CCC([C@H]2C[C@@H](n3cc(I)c4c(N)nc(Cl)nc43)[C@@H]3OC(C)(C)O[C@@H]32)CC1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 12/20 0.34
▸ SRC P12931 3/20 0.33
▸ EGFR P00533 1/20 0.33
▸ NR3C1 P04150 1/20 0.32
▸ STS P08842 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
SCHEMBL30940730 1.00 GPR119 (0.34) GPR119SRCEGFRNR3C1STS
SCHEMBL30941472 0.92 GPR119 (0.35) GPR119NR3C1STS
SCHEMBL25048948 0.92 GPR119 (0.35) GPR119NR3C1STS
SCHEMBL31618088 0.91 SRC (0.33) SRCEGFR
SCHEMBL25048683 0.91 SRC (0.33) SRCEGFR
SCHEMBL30941669 0.91 SRC (0.33) SRCEGFR
SCHEMBL30941314 0.91 GPR119 (0.34) GPR119SRCEGFRNR3C1
SCHEMBL25047540 0.88 SRC (0.45) SRCEGFR
SCHEMBL30941058 0.88 SRC (0.45) SRCEGFR
SCHEMBL25047969 0.85 GPR119 (0.36) GPR119NR3C1

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-2023017152-A1 SPECIFIC SMALL MOLECULE INHIBITORS THAT BLOCK KMT9 METHYLTRANSFERASE ACTIVITY AND FUNCTION ALBERT-LUDWIGS-UNIVERSITÄT FREIBURG (DE) 2023-02-16 — — WO disclosed
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