SCHEMBL9400326

SCHEMBL9400326

CC(=O)ON1C(C)(C)CC(OC(=O)NCCCCCCNC(=O)OC2CC(C)(C)N(OC(C)=O)C(C)(C)C2)CC1(C)C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.50
KMT2A Q03164 3/20 0.44
ALDH1A1 P00352 1/20 0.42
ESR1 P03372 1/20 0.42
HSD17B10 Q99714 1/20 0.42
GAA P10253 2/20 0.41
MEN1 O00255 2/20 0.41
EPHX2 P34913 7/20 0.36
EPHX1 P07099 2/20 0.35
BCHE P06276 1/20 0.34
HPGD P15428 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
LMNA P02545 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPK1 P28482 1/20 0.33
HIF1A Q16665 1/20 0.33
FAAH O00519 1/20 0.33
ABHD16A O95870 1/20 0.33
PLA2G7 Q13093 1/20 0.33
NCEH1 Q6PIU2 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
SCHEMBL8161429 0.82 GAA (0.41) GAAEPHX2EPHX1BCHEHPGD
SCHEMBL12921994 0.80 TSHR (0.61) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL6300772 0.80 TDP1 (0.35) TSHRKMT2AGAAMEN1EPHX2
SCHEMBL10160344 0.80 EPHX1 (0.46) TSHRGAAEPHX2EPHX1
SCHEMBL4026717 0.80 TSHR (0.45) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL1138567 0.78 KMT2A (0.63) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL1948723 0.78 TSHR (0.53) TSHRKMT2AALDH1A1ESR1HSD17B10
SCHEMBL19422677 0.78 GAA (0.49) ALDH1A1GAAEPHX1BCHESGPL1
SCHEMBL14165270 0.78 TDP1 (0.44) GAAEPHX2EPHX1BCHESGPL1
SCHEMBL19422674 0.77 ACHE (0.47) GAAEPHX2EPHX1BCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5300647-A Light stabilizers for polyolefins, other polymers CIBA-GEIGY CORPORATION (US) 1994-04-05 US disclosed
EP-0309400-B1 N-acyloxy hindered amine stabilizers CIBA GEIGY AG (CH) 1994-03-02 EP disclosed
EP-0309400-A2 N-acyloxy hindered amine stabilizers CIBA-GEIGY AG (CH) 1989-03-29 EP disclosed