SCHEMBL9495253

SCHEMBL9495253

CCC(CCOC(=O)O)(CCOC(=O)O)OC(=O)O

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.32
CYP4A11 Q02928 1/20 0.32
THRB P10828 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
SCHEMBL16555149 0.96 THRB (0.30) THRB
SCHEMBL27511925 0.90 THRB (0.31) THRB
SCHEMBL20578328 0.79 FFAR3 (0.35) THRB
SCHEMBL10179585 0.78 THRB (0.32) THRB
SCHEMBL6383412 0.78
Ammonia Solution, Strong SCHEMBL2277689 0.77 FFAR3 (0.33)
Phosphine SCHEMBL10644934 0.77 FFAR3 (0.33)
SCHEMBL28691157 0.77 AKR1B1 (0.34)
SCHEMBL9705191 0.76 THRB (0.36) CYP4F2CYP4A11THRB
SCHEMBL12324835 0.75 KDM4E (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3301084-B1 CONTINUOUS PROCESS FOR PRODUCING 2-METHYLENE ALDEHYDES OXEA GMBH (DE) 2018-12-12 EP disclosed
EP-3301084-A1 CONTINUOUS PROCESS FOR PRODUCING 2-METHYLENE ALDEHYDES OXEA GmbH (DE) 2018-04-04 EP disclosed
EP-0373443-B1 PROCESS FOR OBTAINING 2-ALKYL-BRANCHED ALKANALS FROM ALKANAL MIXTURES BASF Aktiengesellschaft (DE) 1993-03-03 EP disclosed
EP-0373443-A2 Process for obtaining 2-alkyl-branched alkanals from alkanal mixtures BASF Aktiengesellschaft (DE) 1990-06-20 EP disclosed
EP-0058927-B1 PROCESS FOR THE PREPARATION OF ALPHA-ALKYL ACROLEINES BASF Aktiengesellschaft (DE) 1984-05-30 EP disclosed
EP-0058927-A1 Process for the preparation of alpha-alkyl acroleines BASF Aktiengesellschaft (DE) 1982-09-01 EP disclosed