SCHEMBL30769418

SCHEMBL30769418

COC(=O)C(OCc1cccc(OCc2ccccc2)c1)C1CCCCC1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PTGES O14684 1/20 0.47
▸ POLB P06746 1/20 0.47
▸ EPOR P19235 1/20 0.47
▸ CYP3A4 P08684 1/20 0.46
▸ THRB P10828 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ LTA4H P09960 1/20 0.46
▸ MAOB P27338 3/20 0.45
▸ ADAM17 P78536 2/20 0.45
▸ FFAR1 O14842 1/20 0.45
▸ PTPN1 P18031 1/20 0.45
▸ NR4A2 P43354 1/20 0.44
▸ SMPD1 P17405 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL30768465 0.89 FFAR1 (0.48) PTGESPOLBMAOBFFAR1PTPN1
SCHEMBL30769217 0.79 KMT2A (0.47) PTGESPOLBEPORLTA4HMAOB
SCHEMBL1122740 0.75 GPR132 (0.66) MAOBNR4A2SMPD1
SCHEMBL15973260 0.75 FFAR1 (0.62) FFAR1
SCHEMBL19175806 0.75 FFAR1 (0.62) FFAR1
SCHEMBL15973261 0.75 FFAR1 (0.62) FFAR1
SCHEMBL19696089 0.75 FFAR1 (0.62) FFAR1
SCHEMBL31682322 0.75 FFAR1 (0.62) FFAR1
SCHEMBL1123574 0.74 GPR132 (0.58) PTPN1
SCHEMBL1123575 0.74 GPR132 (0.58) PTPN1

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
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