SCHEMBL8020925

SCHEMBL8020925

COC=C(Oc1cccc(CC=NO)c1)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CTBP2 P56545 1/20 0.43
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
CYP1A2 P05177 1/20 0.36
ACHE P22303 4/20 0.35
KDM4E B2RXH2 4/20 0.35
ALDH1A1 P00352 3/20 0.35
EPOR P19235 1/20 0.35
GRIN1 Q05586 1/20 0.34
GRIN2B Q13224 1/20 0.34
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33
GAA P10253 1/20 0.33
TDP1 Q9NUW8 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
SCHEMBL8022470 0.89 CTBP2 (0.37) CTBP2MEN1KMT2AACHEALDH1A1
SCHEMBL8020928 0.88 CTBP2 (0.43) CTBP2MEN1KMT2ACYP1A2ACHE
SCHEMBL8022472 0.81 CTBP2 (0.41) CTBP2MEN1KMT2ACYP1A2ACHE
SCHEMBL6463471 0.74 ATM (0.40) MEN1KMT2AKDM4EALDH1A1GAA
SCHEMBL9456198 0.74 EPHX1 (0.48)
SCHEMBL7777015 0.72 FFAR1 (0.41) CTBP2KDM4EALDH1A1GAA
SCHEMBL9456054 0.71 EDNRA (0.41) MEN1KMT2ACYP1A2ALDH1A1
SCHEMBL7688665 0.70 CYP4F2 (0.40) MEN1KMT2AACHEALDH1A1
SCHEMBL7688662 0.70 CYP4F2 (0.40) MEN1KMT2AACHEALDH1A1
SCHEMBL13433917 0.70 SMN1; SMN2 (0.48) CTBP2MEN1KMT2ACYP1A2ACHE

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
EP-0975587-A1 OXIME ETHER COMPOUNDS, THEIR USE AND INTERMEDIATES FOR PREPARATIONS OF THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-02-02 EP disclosed
WO-1998043949-A1 OXIME ETHER COMPOUNDS, THEIR USE AND INTERMEDIATES FOR PREPARATIONS OF THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-10-08 WO disclosed