SCHEMBL30768488

SCHEMBL30768488

COc1cc(N2CCC(C(OC)OC)CC2)ccc1B1OC(C)(C)C(C)(C)O1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 6/20 0.36
CCR1 P32246 5/20 0.35
ALDH1A1 P00352 3/20 0.34
MAPT P10636 2/20 0.34
LMNA P02545 2/20 0.33
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
THRB P10828 2/20 0.32
POLB P06746 1/20 0.32
HPGD P15428 1/20 0.32
SIRT6 Q8N6T7 1/20 0.32
HIF1A Q16665 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
SCHEMBL30768491 0.87 GAA (0.33) MAPT
SCHEMBL20211859 0.86 DPP4 (0.31) DPP4
SCHEMBL24847164 0.84 DPP4 (0.33) DPP4
SCHEMBL30180168 0.84 DPP4 (0.33) DPP4
SCHEMBL790815 0.82 ALDH1A1 (0.48) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL21876617 0.81 LPL (0.39) MAPT
SCHEMBL30748846 0.81 ALDH1A1 (0.47) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL791178 0.81 ALDH1A1 (0.47) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL17310043 0.81 SIRT6 (0.49) ALDH1A1MAPTMEN1KMT2APOLB
SCHEMBL30768476 0.76 MAPT (0.42) DPP4CCR1ALDH1A1MAPTLMNA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4543871-A1 ESTROGEN RECEPTOR ALPHA DEGRADERS AND USE THEREOF Relay Therapeutics, Inc. (US) 2025-04-30 EP disclosed
WO-2024006781-A1 ESTROGEN RECEPTOR ALPHA DEGRADERS AND USE THEREOF RELAY THERAPEUTICS, INC. (US) 2024-01-04 WO disclosed