SCHEMBL8075340

SCHEMBL8075340

OCC(c1ccccc1)C(O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 3/20 0.44
LMNA P02545 3/20 0.44
SLC6A2 P23975 5/20 0.41
SLC6A4 P31645 5/20 0.41
SLC6A3 Q01959 5/20 0.41
PDE4A P27815 1/20 0.38
CYP2D6 P10635 1/20 0.37
KCNH2 Q12809 1/20 0.37
TRPA1 O75762 2/20 0.37
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
AOC3 Q16853 1/20 0.36
TAAR1 Q96RJ0 1/20 0.35
USP2 O75604 1/20 0.35
SLCO1B1 Q9Y6L6 1/20 0.35

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
SCHEMBL3159098 0.82 TDP1 (0.46) TDP1L3MBTL1LMNASLC6A2SLC6A4
SCHEMBL5873439 0.82 TDP1 (0.50) TDP1L3MBTL1LMNASLC6A2SLC6A4
SCHEMBL27825950 0.82 TDP1 (0.50) TDP1L3MBTL1LMNASLC6A2SLC6A4
SCHEMBL4077892 0.82 TDP1 (0.50) TDP1L3MBTL1LMNASLC6A2SLC6A4
SCHEMBL16265922 0.78 LMNA (0.50) TDP1LMNASLC6A2SLC6A4SLC6A3
SCHEMBL11744344 0.78 SLC6A2 (0.50) TDP1L3MBTL1LMNASLC6A2SLC6A4
Mannitol SCHEMBL27535805 0.78 TSHR (0.58) TDP1L3MBTL1LMNASLC6A2SLC6A4
Alcohol SCHEMBL28032136 0.77 AOC3 (0.46) TDP1L3MBTL1LMNASLC6A2SLC6A4
SCHEMBL3389900 0.77 AOC3 (0.48) TDP1L3MBTL1LMNASLC6A2SLC6A4
SCHEMBL550791 0.77 AOC3 (0.48) TDP1L3MBTL1LMNASLC6A2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6110501-A A TABLET THAT UTILIZES MICROCAPSULES WHEREIN AN ACTIVE SUBSTANCE FORMS THE CORE OF THE MICROCAPSULE AND OTHER CHEMICAL AGENTS(SEEDS) ARE DISPERSED THROUGHOUT THE MICROCAPSULE SHELL TO STRENGTHEN THE SHELL VERION INC. (US) 2000-08-29 US claimed