SCHEMBL25048615

SCHEMBL25048615

Nc1nc(Cl)nc2c1c(-c1nccs1)cn2C1CCC(C2CCNCC2)C1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ADK P55263 1/20 0.37
▸ SRC P12931 7/20 0.33
▸ EGFR P00533 4/20 0.33
▸ FGR P09769 1/20 0.33
▸ EPHA1 P21709 1/20 0.33
▸ TXK P42681 1/20 0.33
▸ FRK P42685 1/20 0.33
▸ PTK6 Q13882 1/20 0.33
▸ LCK P06239 2/20 0.33
▸ TEK Q02763 1/20 0.33
▸ ABL1 P00519 3/20 0.32
▸ ABL2 P42684 3/20 0.32
▸ DNMT1 P26358 1/20 0.31
▸ CHKA P35790 1/20 0.31
▸ FGFR1 P11362 1/20 0.31
▸ FGFR4 P22455 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
SCHEMBL25048614 0.82 ADK (0.41) ADKDNMT1
SCHEMBL25047634 0.82 ADK (0.39) ADKSRCEGFRLCKABL1
SCHEMBL25048046 0.81 PRCP (0.34) ADKSRCEGFRLCKABL1
SCHEMBL25048068 0.81 ADK (0.33) ADKCHKA
SCHEMBL25048024 0.80 SRC (0.35) SRCEGFRFGREPHA1TXK
SCHEMBL25046685 0.79 METTL3 (0.35) DNMT1
SCHEMBL25048608 0.73 SRC (0.35) SRCEGFRFGREPHA1TXK
SCHEMBL25047624 0.71 ADK (0.44) ADK
SCHEMBL30941204 0.71 ADK (0.37) ADK
SCHEMBL25048921 0.71 — —

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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