SCHEMBL25166199

SCHEMBL25166199

CNc1cc(C)nc(Nc2cc3c(c(C4=CCN(C)CCC4)c2)OCC3)n1

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ EHMT2 Q96KQ7 17/20 0.65
▸ EHMT1 Q9H9B1 16/20 0.65
▸ IGF1R P08069 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.33
▸ TP53 P04637 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ MAPK1 P28482 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
SCHEMBL30330037 1.00 EHMT2 (0.65) EHMT2EHMT1IGF1RALDH1A1TP53
SCHEMBL30330092 0.95 EHMT2 (0.64) EHMT2EHMT1IGF1RALDH1A1TP53
SCHEMBL30329957 0.89 EHMT2 (0.51) EHMT2EHMT1TP53MAPTMAPK1
SCHEMBL25166189 0.89 EHMT2 (0.51) EHMT2EHMT1TP53MAPTMAPK1
SCHEMBL25166169 0.89 EHMT2 (0.65) EHMT2EHMT1IGF1RALDH1A1TP53
SCHEMBL25166175 0.85 EHMT2 (0.65) EHMT2EHMT1
SCHEMBL30330202 0.85 EHMT2 (0.65) EHMT2EHMT1
SCHEMBL25166407 0.83 EHMT2 (0.47) EHMT2EHMT1IGF1R
SCHEMBL30329805 0.83 EHMT2 (0.47) EHMT2EHMT1IGF1R
SCHEMBL30330086 0.83 EHMT2 (0.47) EHMT2EHMT1IGF1R

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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