SCHEMBL25166185

SCHEMBL25166185

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

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ EHMT2 Q96KQ7 18/20 0.59
▸ EHMT1 Q9H9B1 17/20 0.59
▸ HAVCR2 Q8TDQ0 1/20 0.34
▸ KCNH2 Q12809 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
SCHEMBL30329796 1.00 EHMT2 (0.59) EHMT2EHMT1HAVCR2KCNH2
SCHEMBL25166399 0.87 EHMT2 (0.57) EHMT2EHMT1
SCHEMBL30329618 0.87 EHMT2 (0.57) EHMT2EHMT1
SCHEMBL30330202 0.86 EHMT2 (0.65) EHMT2EHMT1HAVCR2KCNH2
SCHEMBL25166175 0.86 EHMT2 (0.65) EHMT2EHMT1HAVCR2KCNH2
SCHEMBL25166169 0.80 EHMT2 (0.65) EHMT2EHMT1
SCHEMBL30329712 0.79 EHMT2 (0.47) EHMT2EHMT1
SCHEMBL25166430 0.79 EHMT2 (0.47) EHMT2EHMT1
SCHEMBL25166510 0.78 EHMT2 (0.47) EHMT2EHMT1
SCHEMBL25166432 0.77 EHMT2 (0.68) EHMT2EHMT1HAVCR2KCNH2

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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