SCHEMBL11118601

SCHEMBL11118601

C=CC(=O)N(CCC)CCO

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 2/20 0.45
ZDHHC2 Q9UIJ5 1/20 0.45
TSHR P16473 4/20 0.42
MAPK1 P28482 1/20 0.42
CA12 O43570 3/20 0.40
CA2 P00918 3/20 0.40
CA9 Q16790 3/20 0.40
ALDH1A1 P00352 3/20 0.35
HPGD P15428 2/20 0.35
APP P05067 2/20 0.35
TP53 P04637 1/20 0.34
CA1 P00915 2/20 0.33
ALDH2 P05091 1/20 0.32
TRPV1 Q8NER1 1/20 0.31
THRA P10827 1/20 0.30
THRB P10828 1/20 0.30
POLB P06746 1/20 0.30
APEX1 P27695 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
GABRA1 P14867 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
Ethylene Glycol SCHEMBL28659119 0.94 ZDHHC20 (0.46) ZDHHC20ZDHHC2TSHRMAPK1CA12
SCHEMBL36287 0.91 ZDHHC20 (0.50) ZDHHC20ZDHHC2TSHRMAPK1CA12
SCHEMBL23421740 0.89 ZDHHC20 (0.49) ZDHHC20ZDHHC2TSHRMAPK1CA12
Hydrogen Sulfide SCHEMBL27807905 0.89 ZDHHC20 (0.49) ZDHHC20ZDHHC2TSHRMAPK1CA12
SCHEMBL34620 0.89 ZDHHC20 (0.39) ZDHHC20ZDHHC2TSHRCA12CA2
SCHEMBL22454600 0.88 ZDHHC20 (0.54) ZDHHC20ZDHHC2TSHRCA12CA9
SCHEMBL422327 0.87 ZDHHC20 (0.47) ZDHHC20ZDHHC2TSHRMAPK1CA12
SCHEMBL22984190 0.87 ZDHHC20 (0.38) ZDHHC20ZDHHC2TSHRCA12CA2
SCHEMBL23421037 0.85 ZDHHC20 (0.54) ZDHHC20ZDHHC2TSHRMAPK1CA12
SCHEMBL34682 0.85 ZDHHC20 (0.42) ZDHHC20ZDHHC2TSHRMAPK1CA12

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
US-4432884-A COPOLYMER OF ALKYLOLAMIDE LAND ALKENYL COMPOUND KATAYAMA CHEMICAL WORKS CO., LTD. (JP) 1984-02-21 US claimed
EP-2799503-A1 A printing ink SERICOL LIMITED (GB) 2014-11-05 EP disclosed
US-20130165350-A1 SURFACE LINKERS FOR ARRAY SYNTHESIS AFFYMETRIX, INC. (US) 2013-06-27 US disclosed
US-20120196142-A1 RESIN FILM, POLARIZER PROTECTIVE FILM, POLARIZER, AND LIQUID-CRYSTAL DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2012-08-02 US disclosed
US-20120196142-A1 RESIN FILM, POLARIZER PROTECTIVE FILM, POLARIZER, AND LIQUID-CRYSTAL DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2012-08-02 US disclosed
US-4432884-A COPOLYMER OF ALKYLOLAMIDE LAND ALKENYL COMPOUND KATAYAMA CHEMICAL WORKS CO., LTD. (JP) 1984-02-21 US disclosed