SCHEMBL24547441

SCHEMBL24547441

CCOCOC[C@H](C)OC[C@@H]1CO1

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TDP1 Q9NUW8 2/20 0.36
TSHR P16473 2/20 0.35
MAPK1 P28482 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
SCHEMBL29336223 0.91 SMN1; SMN2 (0.41) ALDH1A1SMN1; SMN2TDP1TSHRMAPK1
SCHEMBL1186550 0.85 TSHR (0.42) ALDH1A1SMN1; SMN2TDP1TSHRMAPK1
SCHEMBL40032 0.83 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2TDP1TSHRMAPK1
SCHEMBL27052120 0.83 SMN1; SMN2 (0.40) ALDH1A1SMN1; SMN2TDP1TSHRMAPK1
SCHEMBL27722135 0.82 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2TDP1TSHRMAPK1
Water SCHEMBL28203785 0.82 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2TDP1TSHRMAPK1
Ammonia Solution, Strong SCHEMBL28794546 0.82 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2TDP1TSHRMAPK1
SCHEMBL19820290 0.81 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2TDP1TSHRMAPK1
SCHEMBL24546292 0.81 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2TDP1TSHRMAPK1
SCHEMBL27052107 0.81 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2TDP1TSHRMAPK1

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-2022128455-A1 LIQUID DETERGENT COMPOSITION FOR HOUSEHOLD OR INDUSTRIAL USE COMPRISING A POLYMER IN THE FORM OF A PULVERULENT SOLID AS THICKENING AGENT SOCIETE D'EXPLOITATION DE PRODUITS POUR LES INDUSTRIES CHIMIQUES SEPPIC (FR) 2022-06-23 WO disclosed