SCHEMBL16045484

SCHEMBL16045484

CC(C)(CCCC(C)(C)OS(=O)(=O)c1ccccc1)OS(=O)(=O)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSIP1 O75475 1/20 0.42
ALDH1A1 P00352 8/20 0.41
HSD11B1 P28845 1/20 0.41
HTR6 P50406 2/20 0.38
TDP1 Q9NUW8 5/20 0.38
PARL Q9H300 1/20 0.38
MAPK1 P28482 1/20 0.38
MAPT P10636 3/20 0.37
KDM4E B2RXH2 2/20 0.37
HPGD P15428 1/20 0.37
KMT2A Q03164 1/20 0.37
NPSR1 Q6W5P4 2/20 0.37
CYP2C19 P33261 1/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
LMNA P02545 1/20 0.36
PKM P14618 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSP90AA1 P07900 1/20 0.36
XBP1 P17861 1/20 0.36

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
SCHEMBL16046048 0.94 PSIP1 (0.43) PSIP1ALDH1A1HSD11B1HTR6TDP1
SCHEMBL28412955 0.89 TDP1 (0.41) PSIP1ALDH1A1TDP1CA12CA1
SCHEMBL16048079 0.85 CYP2D6 (0.42) ALDH1A1HSD11B1TDP1MAPK1MAPT
SCHEMBL8394579 0.85 PSIP1 (0.47) PSIP1ALDH1A1HSD11B1HTR6TDP1
SCHEMBL4135164 0.83 PSIP1 (0.41) PSIP1ALDH1A1HSD11B1HTR6TDP1
SCHEMBL16046028 0.80 TDP1 (0.44) ALDH1A1HSD11B1TDP1MAPK1MAPT
SCHEMBL778532 0.79 ALDH1A1 (0.46) PSIP1ALDH1A1HSD11B1HTR6TDP1
SCHEMBL6900027 0.78 MAPK1 (0.50) PSIP1ALDH1A1HSD11B1HTR6TDP1
Potassium SCHEMBL31565128 0.78 ALDH1A1 (0.44) PSIP1ALDH1A1HSD11B1HTR6TDP1
SCHEMBL28301329 0.78 ALDH1A1 (0.44) PSIP1ALDH1A1HSD11B1HTR6TDP1

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-2969201-B1 NON-PHTHALATE COMPOUNDS AS ELECTRON DONORS FOR POLYOLEFIN CATALYSTS FORMOSA PLASTICS CORP USA (US) 2022-05-04 EP disclosed
US-9790291-B2 Non-phthalate compounds as electron donors for polyolefin catalysts FORMOSA PLASTICS CORPORATION, USA (US) 2017-10-17 US disclosed
EP-2969201-A2 NON-PHTHALATE COMPOUNDS AS ELECTRON DONORS FOR POLYOLEFIN CATALYSTS Formosa Plastics Corporation, U.S.A. (US) 2016-01-20 EP disclosed
WO-2014160012-A2 NON-PHTHALATE COMPOUNDS AS ELECTRON DONORS FOR POLYOLEFIN CATALYSTS FORMOSA PLASTICS CORPORATION, USA (US) 2014-10-02 WO disclosed
US-20140275456-A1 NON-PHTHALATE COMPOUNDS AS ELECTRON DONORS FOR POLYOLEFIN CATALYSTS FORMOSA PLASTICS CORPORATION, USA (US) 2014-09-18 US disclosed