SCHEMBL9754046

SCHEMBL9754046

C=CC(=O)OC(CC(N)=O)C(N)=O

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.35
ALDH1A1 P00352 5/20 0.33
TP53 P04637 3/20 0.33
HIF1A Q16665 3/20 0.33
CYP3A4 P08684 2/20 0.33
FGFR4 P22455 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HPGD P15428 1/20 0.31
APP P05067 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
SCHEMBL11490781 0.77 TSHR (0.40) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL28240246 0.74 TSHR (0.49) TSHRALDH1A1CYP3A4MAPK1HPGD
SCHEMBL6939859 0.72 TSHR (0.39) TSHRSMN1; SMN2
SCHEMBL29871003 0.72 TSHR (0.41) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL10771163 0.71
SCHEMBL8376143 0.71 KDM4E (0.38) ALDH1A1TP53CYP3A4HSD17B10HPGD
SCHEMBL1834806 0.70 TSHR (0.39) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL301336 0.69 TSHR (0.36) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL6928165 0.68 TSHR (0.43) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL27690811 0.68 TSHR (0.36) TSHRALDH1A1TP53HIF1ACYP3A4

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
CN-106669822-B A kind of preparation method of composite bionic mineralising nano biological catalyst 河北工业大学 2019-11-05 CN claimed
JP-3185073-A None JP disclosed
CN-114425618-B Silver-gold core-shell nanowire doped gel film and preparation method and application thereof 西北工业大学 2023-07-04 CN disclosed
CN-110484527-A A kind of deficiency metal organic framework-multienzyme complex and preparation method thereof and its application UNIV TSINGHUA 2019-11-22 CN disclosed
CN-106669822-B A kind of preparation method of composite bionic mineralising nano biological catalyst 河北工业大学 2019-11-05 CN disclosed
JP-H03185073-A CURABLE RESIN COMPOSITION NIPPON SHOKUBAI KAGAKU KOGYO CO LTD 1991-08-13 JP disclosed