SCHEMBL25047882

SCHEMBL25047882

O[C@@H]1[C@H](O)[C@@H](C2CCN(C3CC3)CC2)C[C@H]1n1cc(-c2nc(Cc3ccccc3)cs2)c2cnc(Cl)nc21

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ AXL P30530 9/20 0.32
▸ FLT3 P36888 9/20 0.32
▸ TYRO3 Q06418 9/20 0.32
▸ MERTK Q12866 9/20 0.32
▸ C1S P09871 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
SCHEMBL25048898 0.92 AXL (0.33) AXLFLT3TYRO3MERTKC1S
SCHEMBL25048901 0.90 CNR1 (0.34) AXLFLT3TYRO3MERTK
SCHEMBL30941346 0.90 PRCP (0.32) —
SCHEMBL25048509 0.90 PRCP (0.32) —
Hydrochloric Acid SCHEMBL30941119 0.89 GABRA1 (0.32) AXLFLT3TYRO3MERTK
SCHEMBL30941067 0.88 AXL (0.33) AXLFLT3TYRO3MERTK
SCHEMBL25048508 0.88 AXL (0.33) AXLFLT3TYRO3MERTK
SCHEMBL30941162 0.86 AXL (0.33) AXLFLT3TYRO3MERTK
SCHEMBL25047781 0.86 AXL (0.33) AXLFLT3TYRO3MERTK
SCHEMBL25047580 0.85 MERTK (0.32) MERTK

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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