Sugi Predict

Sugi Predict / Compounds / SCHEMBL30769175

SCHEMBL30769175

SCHEMBL30769175

O=CC1CCN(c2ccc([C@H]3c4ccc(O)cc4CCC34CCCCC4)cc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 17/20 0.47
▸ ESR2 Q92731 14/20 0.41
▸ CA1 P00915 1/20 0.34
▸ CA2 P00918 1/20 0.34
▸ CA7 P43166 1/20 0.34
▸ CA9 Q16790 1/20 0.34
▸ CA14 Q9ULX7 1/20 0.34

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
SCHEMBL30768811 1.00 ESR1 (0.47) ESR1ESR2CA1CA2CA7
SCHEMBL29092227 0.99 ESR1 (0.47) ESR1ESR2CA1CA2CA7
SCHEMBL29092628 0.97 ESR1 (0.45) ESR1ESR2CA1CA2CA7
SCHEMBL29966597 0.97 ESR1 (0.45) ESR1ESR2CA1CA2CA7
SCHEMBL29092607 0.97 ESR1 (0.45) ESR1ESR2CA1CA2CA7
SCHEMBL29966359 0.97 ESR1 (0.45) ESR1ESR2CA1CA2CA7
SCHEMBL30773567 0.91 ESR1 (0.40) ESR1ESR2CA1CA2CA7
SCHEMBL30773586 0.86 ESR1 (0.41) ESR1ESR2
SCHEMBL30773574 0.86 ESR1 (0.41) ESR1ESR2
SCHEMBL30768340 0.85 ESR1 (0.41) ESR1ESR2

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