SCHEMBL25166290

SCHEMBL25166290

CNc1cc(C)nc(Nc2cc3c(c(C4=CCN(C(=O)OC(C)(C)C)CCC4)c2)OCCO3)n1

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ EHMT2 Q96KQ7 15/20 0.47
▸ EHMT1 Q9H9B1 15/20 0.47
▸ JAK1 P23458 1/20 0.39
▸ IGF1R P08069 2/20 0.39

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
SCHEMBL30330245 1.00 EHMT2 (0.47) EHMT2EHMT1JAK1IGF1R
SCHEMBL31108036 1.00 EHMT2 (0.47) EHMT2EHMT1JAK1IGF1R
SCHEMBL30329712 0.94 EHMT2 (0.47) EHMT2EHMT1JAK1IGF1R
SCHEMBL25166430 0.94 EHMT2 (0.47) EHMT2EHMT1JAK1IGF1R
SCHEMBL25166407 0.91 EHMT2 (0.47) EHMT2EHMT1JAK1IGF1R
SCHEMBL30329805 0.91 EHMT2 (0.47) EHMT2EHMT1JAK1IGF1R
SCHEMBL30330086 0.91 EHMT2 (0.47) EHMT2EHMT1JAK1IGF1R
SCHEMBL25166464 0.90 EHMT2 (0.47) EHMT2EHMT1JAK1IGF1R
SCHEMBL31108063 0.89 JAK1 (0.38) EHMT2EHMT1JAK1
SCHEMBL25165936 0.89 JAK1 (0.38) EHMT2EHMT1JAK1

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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