SCHEMBL6150504

SCHEMBL6150504

C=CCCOCCOCCOCCOCCOCCOCCO

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.58
KMT2A Q03164 3/20 0.58
TSHR P16473 6/20 0.53
MAPK1 P28482 1/20 0.53
THRB P10828 1/20 0.39
HTT P42858 1/20 0.39
MAPT P10636 1/20 0.39
ALDH1A1 P00352 3/20 0.38
TP53 P04637 2/20 0.36
HIF1A Q16665 2/20 0.36
HSD17B10 Q99714 1/20 0.36
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
LPAR3 Q9UBY5 2/20 0.30
LPAR2 Q9HBW0 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
SCHEMBL11754046 1.00 MEN1 (0.58) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL10943454 1.00 MEN1 (0.58) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL2471478 1.00 MEN1 (0.58) MEN1KMT2ATSHRMAPK1THRB
Di(Hydroxyethyl)Ether SCHEMBL10943449 0.97 TSHR (0.56) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL2470456 0.97
Tetraethylene Glycol SCHEMBL20718902 0.92 MEN1 (0.61) MEN1KMT2ATSHRMAPK1THRB
Ethylene Glycol SCHEMBL3829138 0.89 TSHR (0.42) MEN1KMT2ATSHRMAPK1ALDH1A1
Triethylene Glycol SCHEMBL18670678 0.86 MEN1 (0.48) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL13284809 0.86 CA2 (0.42) MEN1KMT2ATSHRALDH1A1TP53
SCHEMBL8731771 0.86 CA2 (0.42) MEN1KMT2ATSHRALDH1A1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5162402-A For concrete containing a polymeric composition SANDOZ LTD. (CH) 1992-11-10 US claimed
JP-4175253-A None JP disclosed
EP-1007178-B1 BIFUNCTIONAL CROWN ETHER-BASED CATION-EXCHANGE STATIONARY PHASE FOR LIQUID CHROMATOGRAPHY DIONEX CORP (US) 2005-01-19 EP disclosed
US-5968363-A Bifunctional crown ether-based cation-exchange stationary phase for liquid chromatography DIONEX CORPORATION (US) 1999-10-19 US disclosed
US-5865994-A Bifunctional crown ether-based cation-exchange stationary phase for liquid chromatography DIONEX CORPORATION (US) 1999-02-02 US disclosed
US-5162402-A For concrete containing a polymeric composition SANDOZ LTD. (CH) 1992-11-10 US disclosed
JP-H04175253-A AGENT FOR PREVENTING LOWERING OF FLUIDITY OF CEMENT COMPOSITION N M B:KK 1992-06-23 JP disclosed