SCHEMBL23668016

SCHEMBL23668016

COc1cc2c(NCC3CN(C(=O)O)C3)c3c(nc2cc1OCCCN1CCCC1)CCC3

nearest known ligand 0.64

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EHMT2 Q96KQ7 20/20 0.64
EHMT1 Q9H9B1 1/20 0.49

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
SCHEMBL20720617 0.94 EHMT2 (0.64) EHMT2
Formic Acid SCHEMBL19260652 0.91 EHMT2 (0.61) EHMT2
SCHEMBL19260588 0.89 EHMT2 (0.67) EHMT2
SCHEMBL19260811 0.88 EHMT2 (0.66) EHMT2
SCHEMBL20755638 0.88 EHMT2 (0.66) EHMT2
Formic Acid SCHEMBL19260701 0.87 EHMT2 (0.61) EHMT2
SCHEMBL23668011 0.87 EHMT2 (0.55) EHMT2EHMT1
SCHEMBL20720587 0.87 EHMT2 (0.65) EHMT2
Formic Acid SCHEMBL19260644 0.87 EHMT2 (0.60) EHMT2
SCHEMBL20755622 0.86 EHMT2 (0.76) EHMT2

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
EP-3416963-B1 HISTONE METHYLTRANSFERASE INHIBITORS GLOBAL BLOOD THERAPEUTICS INC (US) 2021-07-28 EP claimed