SCHEMBL2500704

SCHEMBL2500704

CC(=O)CC(=O)OC(=O)c1ccccc1C(=O)OC(=O)CC(C)=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.48
ALDH1A1 P00352 6/20 0.46
LMNA P02545 3/20 0.46
MGAM O43451 1/20 0.43
GAA P10253 1/20 0.43
SI P14410 1/20 0.43
MGAM2 Q2M2H8 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CYP3A4 P08684 2/20 0.42
TP53 P04637 1/20 0.42
MAPK1 P28482 1/20 0.42
HSD17B10 Q99714 3/20 0.41
CFTR P13569 1/20 0.41
POLB P06746 2/20 0.41
KMT2A Q03164 1/20 0.41
KDM4E B2RXH2 2/20 0.40
NPC1 O15118 1/20 0.40
ATM Q13315 1/20 0.40
GLA P06280 1/20 0.39

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
SCHEMBL2500707 0.93 ALDH1A1 (0.49) TSHRALDH1A1LMNATDP1HSD17B10
SCHEMBL11499635 0.88 ALDH1A1 (0.61) TSHRALDH1A1LMNAGAATDP1
SCHEMBL28170961 0.88 LMNA (0.58) TSHRALDH1A1LMNAGAATDP1
SCHEMBL29262199 0.88 ADRB2 (0.46) TSHRALDH1A1GAATDP1L3MBTL1
SCHEMBL17478142 0.86 CTSD (0.54) TSHRALDH1A1LMNAGAAL3MBTL1
SCHEMBL9730289 0.86 ALDH1A1 (0.71) TSHRALDH1A1TDP1L3MBTL1CYP3A4
SCHEMBL5164177 0.82 TSHR (0.55) TSHRALDH1A1LMNATDP1CYP3A4
SCHEMBL7766866 0.81 TSHR (0.59) TSHRALDH1A1LMNATDP1L3MBTL1
SCHEMBL29381574 0.79 TSHR (0.47) TSHRALDH1A1LMNATDP1L3MBTL1
SCHEMBL9768560 0.79 TSHR (0.47) TSHRALDH1A1LMNATDP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11331324-B2 Modified release suspension of eslicarbazepine Jubilant Generics Limited 2022-05-17 US disclosed
CN-112442318-A Bio-based self-repairing photocureable coating and preparation method and application thereof 中国林业科学研究院林产化学工业研究所 2021-03-05 CN disclosed
US-8362297-B2 High protein supplement SCHEELE, GEORGE 2013-01-29 US disclosed
US-20110245158-A1 High Protein Supplement SCHEELE, GEORGE 2011-10-06 US disclosed