SCHEMBL7568618

SCHEMBL7568618

O=C(O)OC(=O)/C=C/C(=O)OC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 7/20 0.42
KEAP1 Q14145 1/20 0.42
NFE2L2 Q16236 1/20 0.42
TSHR P16473 3/20 0.35
TP53 P04637 1/20 0.35
EGLN1 Q9GZT9 1/20 0.35
EGLN3 Q9H6Z9 1/20 0.35
ALDH1A1 P00352 1/20 0.33
ATM Q13315 1/20 0.31
KDM4E B2RXH2 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL4838653 1.00 HCAR2 (0.42) HCAR2KEAP1NFE2L2TSHRTP53
SCHEMBL26660918 0.97 HCAR2 (0.40) HCAR2KEAP1NFE2L2TSHRTP53
SCHEMBL18784689 0.91 HCAR2 (0.55) HCAR2KEAP1NFE2L2TSHRTP53
SCHEMBL18784690 0.91 HCAR2 (0.55) HCAR2KEAP1NFE2L2TSHRTP53
SCHEMBL27550708 0.87 HCAR2 (0.32) HCAR2KEAP1NFE2L2TSHRTP53
SCHEMBL28066038 0.82
SCHEMBL28320146 0.82
SCHEMBL27951533 0.80 TSHR (0.40) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL529629 0.80 TSHR (0.40) HCAR2TSHRTP53EGLN1EGLN3
SCHEMBL27951534 0.80 TSHR (0.40) HCAR2TSHRTP53EGLN1EGLN3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110520939-B Method for manufacturing a cable, electrical conductor, barrier layer and use thereof 莱尼电缆有限责任公司 2022-11-18 CN disclosed
EP-0876499-B1 PROCESS FOR THE PREPARATION OF ASPARTIC ACID AMYLUM EUROPE NV (BE) 2002-09-04 EP disclosed
US-5972662-A Process for the preparation of aspartic acid AMYLUM N.V. (BE) 1999-10-26 US disclosed
EP-0876499-A1 PROCESS FOR THE PREPARATION OF ASPARTIC ACID AMYLUM, N.V. (BE) 1998-11-11 EP disclosed
WO-1997027312-A1 PROCESS FOR THE PREPARATION OF ASPARTIC ACID AMYLUM N.V. (BE) 1997-07-31 WO disclosed