SCHEMBL25047528

SCHEMBL25047528

Clc1ncc2c(-c3nc(Cc4ccccc4)cs3)cn(C3CCC(C4CCN(CC5CC5)CC4)C3)c2n1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TYRO3 Q06418 9/20 0.37
▸ KCNH2 Q12809 5/20 0.33
▸ CNR1 P21554 4/20 0.33
▸ DRD2 P14416 4/20 0.33
▸ DRD4 P21917 4/20 0.33
▸ DRD3 P35462 3/20 0.33
▸ SIGMAR1 Q99720 1/20 0.33
▸ MERTK Q12866 8/20 0.33
▸ AXL P30530 6/20 0.33
▸ FLT3 P36888 6/20 0.33
▸ WEE1 P30291 1/20 0.32
▸ INSR P06213 1/20 0.32
▸ IGF1R P08069 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
SCHEMBL25046677 0.91 HTR2A (0.34) TYRO3KCNH2DRD2DRD4DRD3
SCHEMBL25048022 0.90 AXL (0.36) TYRO3MERTKAXLFLT3WEE1
SCHEMBL25046690 0.87 ALK (0.34) TYRO3MERTKAXLFLT3
SCHEMBL25048916 0.85 AXL (0.36) TYRO3MERTKAXLFLT3
SCHEMBL25048901 0.85 CNR1 (0.34) TYRO3KCNH2CNR1DRD2DRD4
SCHEMBL25048045 0.83 AXL (0.33) TYRO3DRD2DRD4DRD3MERTK
SCHEMBL25047581 0.83 MERTK (0.32) TYRO3MERTKAXLFLT3
SCHEMBL25048632 0.80 KCNH2 (0.34) KCNH2CNR1DRD2DRD4DRD3
SCHEMBL25048047 0.79 C1S (0.33) KCNH2DRD2DRD4DRD3SIGMAR1
SCHEMBL25048943 0.78 C1S (0.35) TYRO3KCNH2DRD2DRD4DRD3

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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