SCHEMBL29614642

SCHEMBL29614642

COC=C1CCN(C(=O)OC(C)(C)C)CC1(C)C

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 2/20 0.41
GRM5 P41594 8/20 0.40
USP2 O75604 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ESR2 Q92731 1/20 0.39
ADORA1 P30542 1/20 0.36
MAPT P10636 3/20 0.35
KDM4E B2RXH2 2/20 0.35
THRB P10828 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
DDB1 Q16531 1/20 0.35
CRBN Q96SW2 1/20 0.35
RORC P51449 1/20 0.35

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
SCHEMBL29614722 1.00 NR1H2 (0.41) NR1H2GRM5USP2SMN1; SMN2ESR2
SCHEMBL31565399 0.85 ESR2 (0.40) NR1H2GRM5USP2SMN1; SMN2ESR2
SCHEMBL3881781 0.85 GRM5 (0.42) NR1H2GRM5USP2SMN1; SMN2ESR2
SCHEMBL3881785 0.85 GRM5 (0.42) NR1H2GRM5USP2SMN1; SMN2ESR2
SCHEMBL29915399 0.84 NR1H2 (0.42) NR1H2GRM5USP2SMN1; SMN2ESR2
SCHEMBL31669964 0.84 ESR2 (0.36) NR1H2GRM5USP2SMN1; SMN2ESR2
SCHEMBL3880132 0.83 NR1H2 (0.41) NR1H2GRM5USP2SMN1; SMN2ESR2
SCHEMBL3880129 0.83 NR1H2 (0.41) NR1H2GRM5USP2SMN1; SMN2ESR2
SCHEMBL3878421 0.82 NR1H2 (0.41) NR1H2GRM5USP2SMN1; SMN2ESR2
SCHEMBL3878423 0.82 NR1H2 (0.41) NR1H2GRM5USP2SMN1; SMN2ESR2

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-4240743-A1 BRM TARGETING COMPOUNDS AND ASSOCIATED METHODS OF USE Prelude Therapeutics, Incorporated (US) 2023-09-13 EP disclosed
WO-2022099117-A1 BRM TARGETING COMPOUNDS AND ASSOCIATED METHODS OF USE PRELUDE THERAPEUTICS INCORPORATED (US) 2022-05-12 WO disclosed