SCHEMBL31399323

SCHEMBL31399323

C=CCOCC(COCC1COC(C)(C)O1)(COCC1COC(C)(C)O1)COCC1COC(C)(C)O1

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.45
CA2 P00918 2/20 0.43
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34
NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL9580528 0.89 ALDH1A1 (0.56) ALDH1A1CA2TSHRMAPK1NPSR1
SCHEMBL46416 0.89 ALDH1A1 (0.56) ALDH1A1CA2TSHRMAPK1NPSR1
SCHEMBL9778093 0.89 ALDH1A1 (0.56) ALDH1A1CA2TSHRMAPK1NPSR1
SCHEMBL24427703 0.79 ALDH1A1 (0.71) ALDH1A1TSHRMAPK1
SCHEMBL408541 0.79 ALDH1A1 (0.41) ALDH1A1CA2
SCHEMBL31399379 0.78 CA2 (0.47) ALDH1A1CA2TSHRMAPK1NPSR1
SCHEMBL11932963 0.78 ALDH1A1 (0.41) ALDH1A1CA2
SCHEMBL3428396 0.77 CA2 (0.53) ALDH1A1CA2TSHRMAPK1NPSR1
SCHEMBL11023633 0.77 ALDH1A1 (0.41) ALDH1A1CA2NPSR1
SCHEMBL7875753 0.77 CA2 (0.59) ALDH1A1CA2TSHRMAPK1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025023235-A1 BRANCHED MULTI-HYDROXYL-PROTECTING OLIGOMER, LINKED BODY BONDED THEREWITH, AND BRANCHED MULTI-HYDROXYL OLIGOMER OBTAINED BY DEPROTECTING SAID LINKED BODY トモイケ バイオ リミテッド 2025-01-30 WO disclosed