SCHEMBL30723926

SCHEMBL30723926

COc1cc(N2CCC(C(OC)OC)CC2)ccc1C1=C(c2ccccc2)CCCc2c1ccc1c2c(F)nn1C1CCCCO1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EHMT2 Q96KQ7 4/20 0.32
HIF1A Q16665 1/20 0.30
PDE7A Q13946 3/20 0.30
PDE7B Q9NP56 1/20 0.30

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
SCHEMBL30724013 0.92 ESR1 (0.30)
SCHEMBL30724000 0.87 CCR1 (0.32) EHMT2
SCHEMBL30723949 0.87 EHMT2 (0.33) EHMT2
SCHEMBL30724147 0.85 RET (0.32)
SCHEMBL30723812 0.84
SCHEMBL30724064 0.84 DGAT2 (0.33)
SCHEMBL30724062 0.84 DGAT2 (0.33)
SCHEMBL30723867 0.84 NPC1 (0.33) EHMT2
SCHEMBL30724076 0.84 ESR1 (0.35)
SCHEMBL30723863 0.84 ATR (0.31)

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-2024006776-A1 ESTROGEN RECEPTOR ALPHA DEGRADERS AND MEDICAL USE THEREOF RELAY THERAPEUTICS, INC. (US) 2024-01-04 WO disclosed