SCHEMBL588660

SCHEMBL588660

C=CC(=O)NN(CCCCCCO)CCCCCCO

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 2/20 0.39
ZDHHC2 Q9UIJ5 2/20 0.39
ALDH1A1 P00352 2/20 0.35
TSHR P16473 2/20 0.35
MAPK1 P28482 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
GPR84 Q9NQS5 1/20 0.31
FFAR1 O14842 1/20 0.31
FFAR4 Q5NUL3 1/20 0.31
THRA P10827 1/20 0.31
THRB P10828 1/20 0.31
LMNA P02545 2/20 0.30
HSD17B10 Q99714 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
FAAH O00519 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
SCHEMBL588261 0.84 TSHR (0.41) ZDHHC20ZDHHC2ALDH1A1TSHRMAPK1
SCHEMBL176142 0.73 TSHR (0.35) ZDHHC20ZDHHC2ALDH1A1TSHRMAPK1
SCHEMBL588661 0.73 TSHR (0.37) ZDHHC20ZDHHC2ALDH1A1TSHRMAPK1
SCHEMBL442128 0.69 ZDHHC20 (0.68) ZDHHC20ZDHHC2ALDH1A1TSHRMAPK1
SCHEMBL29257670 0.69 ZDHHC20 (0.68) ZDHHC20ZDHHC2ALDH1A1TSHRMAPK1
SCHEMBL24652920 0.69 ZDHHC20 (0.68) ZDHHC20ZDHHC2ALDH1A1TSHRMAPK1
SCHEMBL28562520 0.69 ZDHHC20 (0.68) ZDHHC20ZDHHC2ALDH1A1TSHRMAPK1
SCHEMBL3775886 0.69 ZDHHC20 (0.68) ZDHHC20ZDHHC2ALDH1A1TSHRMAPK1
SCHEMBL589146 0.69 ZDHHC20 (0.50) ZDHHC20ZDHHC2ALDH1A1TSHRGPR84
SCHEMBL27872961 0.69 ZDHHC20 (0.68) ZDHHC20ZDHHC2ALDH1A1TSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8114819-B2 Polymers for oilfield applications BAKER HUGHES INCORPORATED (US) 2012-02-14 US disclosed
US-20100105580-A1 Polymers For Oilfield Applications BJ SERVICES COMPANY (US) 2010-04-29 US disclosed