SCHEMBL2294082

SCHEMBL2294082

COCC(=O)N[C@@H](C)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.51
ALDH1A1 P00352 3/20 0.51
KDM4E B2RXH2 2/20 0.51
TSHR P16473 2/20 0.50
HSD17B10 Q99714 1/20 0.46
MAPT P10636 2/20 0.42
FAAH O00519 3/20 0.41
HPGD P15428 2/20 0.41
ALOX12 P18054 1/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
MME P08473 1/20 0.40
ACE P12821 1/20 0.40
CPA1 P15085 1/20 0.40
ACE2 Q9BYF1 1/20 0.40
SLC6A5 Q9Y345 1/20 0.39
NPSR1 Q6W5P4 1/20 0.37
CYP2C19 P33261 1/20 0.37

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
SCHEMBL2294079 1.00 SMN1; SMN2 (0.51) SMN1; SMN2ALDH1A1KDM4ETSHRHSD17B10
SCHEMBL3397754 1.00 SMN1; SMN2 (0.51) SMN1; SMN2ALDH1A1KDM4ETSHRHSD17B10
SCHEMBL3673892 0.83 TSHR (0.50) SMN1; SMN2ALDH1A1KDM4ETSHRMAPT
SCHEMBL3673890 0.83 TSHR (0.50) SMN1; SMN2ALDH1A1KDM4ETSHRMAPT
SCHEMBL25646522 0.83 TSHR (0.46) SMN1; SMN2ALDH1A1KDM4ETSHRHPGD
SCHEMBL28127289 0.83 TSHR (0.50) SMN1; SMN2ALDH1A1KDM4ETSHRMAPT
SCHEMBL9954665 0.81 TSHR (0.44) SMN1; SMN2ALDH1A1KDM4ETSHRHPGD
SCHEMBL9911441 0.81 ALDH1A1 (0.50) SMN1; SMN2ALDH1A1KDM4ETSHRHSD17B10
SCHEMBL5128332 0.81 TSHR (0.44) SMN1; SMN2ALDH1A1KDM4ETSHRHPGD
SCHEMBL1036877 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107011202-B A kind of vertical synthetic method up to mould metabolite 12 上海海洋大学 2018-08-14 CN claimed
EP-3544422-A1 SEED COATING COMPOSITION Incotec Holding B.V. (NL) 2019-10-02 EP disclosed
CN-106905181-B A kind of vertical synthetic method up to mould metabolite 16 上海海洋大学 2018-10-09 CN disclosed
EP-3373728-A1 SEED COATING COMPOSITION Incotec Holding B.V. (NL) 2018-09-19 EP disclosed
CN-107011202-B A kind of vertical synthetic method up to mould metabolite 12 上海海洋大学 2018-08-14 CN disclosed
CN-107011202-B A kind of vertical synthetic method up to mould metabolite 12 上海海洋大学 2018-08-14 CN disclosed
WO-2018096394-A1 SEED COATING COMPOSITION INCOTEC HOLDING B.V. (NL) 2018-05-31 WO disclosed
CN-106431962-B It is vertical to reach the mould metabolin in grass carp body 上海海洋大学 2018-04-06 CN disclosed
CN-107011202-A A kind of vertical synthetic method up to mould metabolite 12 上海海洋大学 2017-08-04 CN disclosed
CN-107011202-A A kind of vertical synthetic method up to mould metabolite 12 上海海洋大学 2017-08-04 CN disclosed
CN-106905181-A A kind of vertical synthetic method up to mould metabolite 16 上海海洋大学 2017-06-30 CN disclosed
WO-2017081535-A1 SEED COATING COMPOSITION INCOTEC HOLDING B.V. (NL) 2017-05-18 WO disclosed
US-8232228-B2 Method for increasing the efficacy of agricultural chemicals PLANT HEALTH CARE, INC. (US) 2012-07-31 US disclosed
WO-2011085067-A1 AQUEOUS-MISCIBLE OR AQUEOUS-DISPERSIBLE, VOC-FREE BIOCIDAL COMPOSITIONS FOR THE ENHANCED INHIBITION OF GRAM-NEGATIVE BACTERIAL STRAINS, AND METHOD OF PREPARING THE SAME ISP INVESTMENT INC. (US) 2011-07-14 WO disclosed
US-20070037705-A1 Method for Increasing the Efficacy of Agricultural Chemicals PLANT HEALTH CARE, INC. 2007-02-15 US disclosed
EP-1103560-B1 NOVEL THIAZOLIDINE DERIVATIVES SANTEN PHARMACEUTICAL CO LTD (JP) 2006-12-27 EP disclosed
US-6410576-B1 ANTIINFLAMMATORY AGENTS; CARDIOVASCULAR DISORDERS SANTEN PHARMACEUTICAL CO., LTD. (JP) 2002-06-25 US disclosed
EP-1103560-A1 NOVEL THIAZOLIDINE DERIVATIVES SANTEN PHARMACEUTICAL CO., LTD. (JP) 2001-05-30 EP disclosed