SCHEMBL23267828

SCHEMBL23267828

CC(C)(C)CC(C)(C)C(=O)C(C)(C)CC(C)(C)O

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.32
HMGCR P04035 1/20 0.31
CHRM1 P11229 1/20 0.31
TBXA2R P21731 1/20 0.31
ADRA1A P35348 1/20 0.31
TSHR P16473 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
SCHEMBL19787617 0.81 ALDH1A1 (0.33) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
SCHEMBL25530283 0.78
SCHEMBL14380221 0.77 GRM4 (0.30)
SCHEMBL20635493 0.77 TSHR (0.35) ALDH1A1TSHR
SCHEMBL23267555 0.75 ALDH1A1 (0.36) ALDH1A1TSHR
SCHEMBL19706366 0.74 CES2 (0.35)
SCHEMBL16671676 0.73
SCHEMBL102085 0.73
SCHEMBL13316716 0.72 ALDH1A1 (0.47) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
SCHEMBL12463880 0.70 ALDH1A1 (0.33) ALDH1A1HMGCRCHRM1TBXA2RADRA1A

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
WO-2024020221-A1 MODULATORS OF TYK2 PROTEOLYSIS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. (US) 2024-01-25 WO disclosed
WO-2021077010-A1 BIFUNCTIONAL MOLECULES CONTAINING AN E3 UBIQUITINE LIGASE BINDING MOIETY LINKED TO A BCL6 TARGETING MOIETY ARVINAS OPERATIONS, INC. (US) 2021-04-22 WO disclosed