SCHEMBL25166175

SCHEMBL25166175

CNc1cc(C)nc(Nc2cc3c(c(C4=CCN(C)CCC4)c2)OCO3)n1

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ EHMT2 Q96KQ7 17/20 0.65
▸ EHMT1 Q9H9B1 16/20 0.65
▸ HAVCR2 Q8TDQ0 1/20 0.35
▸ AURKA O14965 1/20 0.34
▸ AURKB Q96GD4 1/20 0.34
▸ KCNH2 Q12809 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
SCHEMBL30330202 1.00 EHMT2 (0.65) EHMT2EHMT1HAVCR2AURKAAURKB
SCHEMBL25166169 0.93 EHMT2 (0.65) EHMT2EHMT1
SCHEMBL30329788 0.87 EHMT2 (0.49) EHMT2EHMT1
SCHEMBL25166244 0.87 EHMT2 (0.49) EHMT2EHMT1
SCHEMBL30329796 0.86 EHMT2 (0.59) EHMT2EHMT1HAVCR2KCNH2
SCHEMBL25166185 0.86 EHMT2 (0.59) EHMT2EHMT1HAVCR2KCNH2
SCHEMBL30330037 0.85 EHMT2 (0.65) EHMT2EHMT1
SCHEMBL25166199 0.85 EHMT2 (0.65) EHMT2EHMT1
SCHEMBL25166023 0.85 EHMT2 (0.62) EHMT2EHMT1
SCHEMBL30329826 0.85 EHMT2 (0.62) EHMT2EHMT1

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-2023064586-A1 NOVEL MODULATORS OF EHMT1 AND EHMT2 AND THERAPEUTIC USE THEREOF TANGO THERAPEUTICS, INC. (US) 2023-04-20 — — WO disclosed
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