SCHEMBL25048780

SCHEMBL25048780

C/C=C(\C)CCNCCCNC[C@@H]1CC[C@H](n2cc(-c3ccn(SC)n3)c3cnc(Cl)nc32)C1

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ AXL P30530 5/20 0.31
▸ TYRO3 Q06418 5/20 0.31
▸ MERTK Q12866 5/20 0.31
▸ FLT3 P36888 4/20 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
SCHEMBL25048346 0.88 — —
SCHEMBL25048334 0.88 — —
SCHEMBL25048778 0.87 AXL (0.34) AXLTYRO3MERTKFLT3
SCHEMBL25048237 0.81 AXL (0.33) AXLTYRO3MERTKFLT3
SCHEMBL25048238 0.81 AXL (0.33) AXLTYRO3MERTKFLT3
SCHEMBL25048791 0.74 IGF1R (0.33) —
SCHEMBL25047686 0.74 AXL (0.32) AXLTYRO3MERTKFLT3
SCHEMBL25048193 0.74 ABL1 (0.42) FLT3
SCHEMBL25049103 0.69 ADK (0.38) —
SCHEMBL25046702 0.69 METTL3 (0.32) —

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
Send feedback