SCHEMBL3698562

SCHEMBL3698562

COCC(=O)OCCOCCO

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
TSHR P16473 6/20 0.42
MAPK1 P28482 2/20 0.42
THRB P10828 2/20 0.38
HTT P42858 1/20 0.38
EPHX2 P34913 1/20 0.38
MAPT P10636 1/20 0.38
ALDH1A1 P00352 5/20 0.36
TP53 P04637 2/20 0.34
HIF1A Q16665 2/20 0.34
HSD17B10 Q99714 1/20 0.34
CA2 P00918 1/20 0.34
USP2 O75604 1/20 0.33
LMNA P02545 1/20 0.33
CYP3A4 P08684 1/20 0.33
CASP1 P29466 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
SLCO1B3 Q9NPD5 1/20 0.33
SLCO1B1 Q9Y6L6 1/20 0.33

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
SCHEMBL26428512 1.00 MEN1 (0.46) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL7692982 1.00 MEN1 (0.46) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL18470077 0.91 TSHR (0.39) TSHRTHRBMAPTALDH1A1TP53
SCHEMBL2610085 0.91 TSHR (0.39) TSHRTHRBMAPTALDH1A1TP53
SCHEMBL16638373 0.88 CYP4F2 (0.37) MEN1KMT2ATSHRTHRBHTT
SCHEMBL13313904 0.87 TSHR (0.39) TSHRTHRBMAPTALDH1A1TP53
SCHEMBL2842381 0.87
SCHEMBL4528968 0.85 MEN1 (0.52) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL18470076 0.83 ALDH1A1 (0.54) KMT2ATSHRTHRBEPHX2ALDH1A1
SCHEMBL16865885 0.83 DGKA (0.41) TSHRTHRBEPHX2ALDH1A1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100275807-A1 PHOTOLUMINESCENT NANOCRYSTAL BASED TAGGANTS EVIDENT TECHNOLOGIES, INC. 2010-11-04 US disclosed
EP-0769531-B1 Ink jet recording ink containing an azomethine dye KONISHIROKU PHOTO IND (JP) 2002-10-02 EP disclosed
US-5753017-A EJECTING INK COMPRISING SPECIFIED DYE ONTO RECEIVING MATERIAL USING INK JET PRINTER KONICA CORPORATION (JP) 1998-05-19 US disclosed
EP-0769531-A1 Ink jet recording ink containing an azomethine dye KONICA CORPORATION (JP) 1997-04-23 EP disclosed
US-4448031-A Process for cold and/or heat production with use of carbon dioxide and a condensable fluid INSTITUT FRANCAIS DU PETROLE (FR) 1984-05-15 US disclosed
US-4433554-A Process for producing cold and/or heat by use of an absorption cycle with carbon dioxide as working fluid INSTITUT FRANCAIS DU PETROLE (FR) 1984-02-28 US disclosed
US-4390474-A PETROLEUM OIL FEEDSTOCK AND ADDITIVE WHICH ARE SULFONATED STEPAN CHEMICAL COMPANY (US) 1983-06-28 US disclosed
EP-0012759-B1 STABILIZED PETROLEUM SULFONATE PRODUCTS AND THEIR USE IN SUBTERRANEAN OIL RECOVERY STEPAN CHEMICAL COMPANY (US) 1982-05-05 EP disclosed
US-4252192-A SULFONATION OF PETROLEUM OILS, NEUTRALIZATION STEPAN CHEMICAL COMPANY (US) 1981-02-24 US disclosed
EP-0012759-A1 Stabilized petroleum sulfonate products and their use in subterranean oil recovery. STEPAN CHEMICAL CO (US) 1980-07-09 EP disclosed
US-4177207-A SULFONATION OF PETROLEUM FEEDSTOCK IN PRESENCE OF ADDITIVE; USED FOR ENHANCED OIL RECOVERY STEPAN CHEMICAL COMPANY (US) 1979-12-04 US disclosed
WO-1979000701-A1 IMPROVED PETROLEUM SULFONATES STEPAN CHEMICAL CO (US) 1979-09-20 WO disclosed
US-4148821-A OF PETROLEUM FEEDSTOCK STEPAN CHEMICAL COMPANY (US) 1979-04-10 US disclosed