SCHEMBL25166244

SCHEMBL25166244

CNc1cc(C)nc(Nc2cc3c(c(C4=CCN(C)CCC4)c2)OCO3)c1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ EHMT2 Q96KQ7 12/20 0.49
▸ EHMT1 Q9H9B1 12/20 0.49
▸ NPC1 O15118 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ SMN1; SMN2 Q16637 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
SCHEMBL30329788 1.00 EHMT2 (0.49) EHMT2EHMT1NPC1RAB9AKMT2A
SCHEMBL30329782 0.93 EHMT2 (0.49) EHMT2EHMT1
SCHEMBL25166243 0.93 EHMT2 (0.49) EHMT2EHMT1
SCHEMBL30330202 0.87 EHMT2 (0.65) EHMT2EHMT1
SCHEMBL25166175 0.87 EHMT2 (0.65) EHMT2EHMT1
SCHEMBL25166453 0.83 JAK1 (0.39) EHMT2EHMT1
SCHEMBL30329643 0.83 JAK1 (0.39) EHMT2EHMT1
SCHEMBL30330157 0.83 JAK1 (0.39) EHMT2EHMT1
SCHEMBL25166186 0.82 EHMT2 (0.51) EHMT2EHMT1NPC1RAB9AKMT2A
SCHEMBL30330220 0.82 EHMT2 (0.51) EHMT2EHMT1NPC1RAB9AKMT2A

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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