SCHEMBL25046690

SCHEMBL25046690

Clc1ncc2c(-c3nc(Cc4ccccc4)cs3)cn(C3CCC(C4CCNCC4)C3)c2n1

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ALK Q9UM73 1/20 0.34
▸ MERTK Q12866 11/20 0.34
▸ AXL P30530 10/20 0.34
▸ TYRO3 Q06418 10/20 0.34
▸ FLT3 P36888 9/20 0.33
▸ C1S P09871 1/20 0.32
▸ GABRA1 P14867 1/20 0.31
▸ GABRB2 P47870 1/20 0.31
▸ MET P08581 1/20 0.31
▸ SRC P12931 5/20 0.30
▸ EGFR P00533 1/20 0.30

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
SCHEMBL25047581 0.90 MERTK (0.32) MERTKAXLTYRO3FLT3C1S
SCHEMBL25048022 0.89 AXL (0.36) MERTKAXLTYRO3FLT3MET
SCHEMBL25046677 0.87 HTR2A (0.34) MERTKAXLTYRO3FLT3
SCHEMBL25047528 0.87 TYRO3 (0.37) MERTKAXLTYRO3FLT3
SCHEMBL25048024 0.86 SRC (0.35) C1SGABRA1GABRB2SRCEGFR
SCHEMBL25048916 0.85 AXL (0.36) MERTKAXLTYRO3FLT3MET
Hydrochloric Acid SCHEMBL30941119 0.83 GABRA1 (0.32) ALKMERTKAXLTYRO3FLT3
SCHEMBL25048045 0.83 AXL (0.33) MERTKAXLTYRO3FLT3
SCHEMBL25048097 0.83 AXL (0.32) MERTKAXLTYRO3FLT3
SCHEMBL25047541 0.82 SRC (0.49) SRCEGFR

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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