SCHEMBL3041245

SCHEMBL3041245

O=C(CO)OCC(=O)OC(=O)CO

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
PAM P19021 1/20 0.31

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
SCHEMBL132924 0.82
SCHEMBL13144599 0.80 PAM (0.32) PAM
SCHEMBL2131209 0.78 ALDH1A1 (0.40) ALDH1A1
SCHEMBL15282788 0.78 ADRA2A (0.37) PAM
SCHEMBL15260571 0.78 ADRA2A (0.37) PAM
SCHEMBL12860828 0.78 ADRA2A (0.37) PAM
SCHEMBL15282749 0.76 PAM (0.48) PAM
SCHEMBL13876110 0.76 PAM (0.48) PAM
SCHEMBL9305080 0.76 TSHR (0.46) ALDH1A1
SCHEMBL17644472 0.76 PAM (0.30) PAM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2831031-A1 HYDROCARBOXYLATION OF METHYLENE DIPROPIONATE IN THE PRESENCE OF PROPIONIC ACID AND A HETEROGENEOUS CATALYST Eastman Chemical Company (US) 2015-02-04 EP disclosed
CN-104185619-A Hydrocarboxylation of methylene dipropionate in presence of propionic acid and heterogeneous catalyst EASTMAN CHEM CO 2014-12-03 CN disclosed
WO-2013148507-A1 HYDROCARBOXYLATION OF METHYLENE DIPROPIONATE IN THE PRESENCE OF PROPIONIC ACID AND A HETEROGENEOUS CATALYST EASTMAN CHEMICAL COMPANY (US) 2013-10-03 WO disclosed
WO-2010084055-A2 HAIR COLOURING COMPOSITION UNILEVER PLC (GB) 2010-07-29 WO disclosed
WO-1999037281-A1 SKIN CARE COSMETIC METHOD AND SYSTEM UNILEVER PLC (GB) 1999-07-29 WO disclosed