SCHEMBL7004423

SCHEMBL7004423

CCCCCCCCCCOC(=O)C(S)Cc1cc(C)c(O)c(C)c1

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 5/20 0.58
AKR1C4 P17516 1/20 0.46
AKR1C3 P42330 1/20 0.46
AKR1C2 P52895 1/20 0.46
AKR1C1 Q04828 1/20 0.46
GPR84 Q9NQS5 1/20 0.39
TSHR P16473 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39

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
SCHEMBL714804 1.00 ESR1 (0.58) ESR1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL870709 0.83 HMGCR (0.45) ESR1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL581163 0.83 HMGCR (0.45) ESR1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL937841 0.80 ESR1 (0.49) ESR1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL10567300 0.79 TSHR (0.53) TSHRALDH1A1LMNA
SCHEMBL8669877 0.78 ESR1 (0.49) ESR1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL10978353 0.76 ESR1 (0.56) ESR1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL38945 0.76 ESR1 (0.49) ESR1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL9230453 0.75 ESR1 (0.61) ESR1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL17491275 0.75 ESR1 (0.61) ESR1AKR1C4AKR1C3AKR1C2AKR1C1

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-3774997-A1 HYPERBRANCHED POLYETHERS AND THEIR USE, ESPECIALLY AS POUR POINT DEPRESSANT AND WAX INHIBITORS BASF SE (DE) 2021-02-17 EP disclosed
EP-3774996-A1 NOVEL HYPERBRANCHED POLYESTERS AND THEIR USE AS WAX INHIBITOR, AS POUR POINT DEPRESSANT, AS LUBRICANT OR IN LUBRICATING OILS BASF SE (DE) 2021-02-17 EP disclosed
WO-2019185490-A1 HYPERBRANCHED POLYETHERS AND THEIR USE, ESPECIALLY AS POUR POINT DEPRESSANT AND WAX INHIBITORS BASF SE (DE) 2019-10-03 WO disclosed
WO-2019185401-A1 NOVEL HYPERBRANCHED POLYESTERS AND THEIR USE AS WAX INHIBITOR, AS POUR POINT DEPRESSANT, AS LUBRICANT OR IN LUBRICATING OILS BASF SE (DE) 2019-10-03 WO disclosed
EP-1282630-A1 HYDROXYLAMINE ESTERS AS POLYMERIZATION INITIATORS Ciba SC Holding AG (CH) 2003-02-12 EP disclosed
WO-2001090113-A1 HYDROXYLAMINE ESTERS AS POLYMERIZATION INITIATORS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2001-11-29 WO disclosed