SCHEMBL2759892

SCHEMBL2759892

CCCCCCCCCCCSC(C)=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 6/20 0.56
POLB P06746 2/20 0.50
BLM P54132 2/20 0.50
GMNN O75496 1/20 0.50
TP53 P04637 1/20 0.50
MAPT P10636 1/20 0.50
THRB P10828 1/20 0.50
CYP2C9 P11712 1/20 0.50
HSD17B10 Q99714 1/20 0.50
ACHE P22303 3/20 0.46
EPHX1 P07099 1/20 0.45
CYP2C19 P33261 1/20 0.44
CES1 P23141 7/20 0.44
FAAH O00519 4/20 0.44
PLA2G6 O60733 1/20 0.44
HDAC11 Q96DB2 2/20 0.43
HDAC3 O15379 1/20 0.43
HDAC4 P56524 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC7 Q8WUI4 1/20 0.43

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
SCHEMBL27971189 1.00 CES2 (0.56) CES2POLBBLMGMNNTP53
SCHEMBL14611674 1.00 CES2 (0.56) CES2POLBBLMGMNNTP53
SCHEMBL2759893 1.00 CES2 (0.56) CES2POLBBLMGMNNTP53
SCHEMBL9430010 1.00 CES2 (0.56) CES2POLBBLMGMNNTP53
SCHEMBL11303853 1.00 CES2 (0.56) CES2POLBBLMGMNNTP53
SCHEMBL12676448 1.00 CES2 (0.56) CES2POLBBLMGMNNTP53
SCHEMBL14155064 1.00 CES2 (0.56) CES2POLBBLMGMNNTP53
SCHEMBL4649867 1.00 CES2 (0.56) CES2POLBBLMGMNNTP53
SCHEMBL21806974 1.00 CES2 (0.56) CES2POLBBLMGMNNTP53
SCHEMBL27971187 1.00 CES2 (0.56) CES2POLBBLMGMNNTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113651739-B Oligo-ethylene glycol fluorinated aromatic ring organic small molecule and preparation method and application thereof 山东师范大学 2023-01-03 CN claimed
CN-113651739-B Oligo-ethylene glycol fluorinated aromatic ring organic small molecule and preparation method and application thereof 山东师范大学 2023-01-03 CN disclosed
CN-113651739-A Oligo-ethylene glycol fluorinated aromatic ring organic small molecule and preparation method and application thereof 山东师范大学 2021-11-16 CN disclosed
CN-102782102-B Lubricating composition containing an antiwear agent LUBRIZOL CORP 2014-09-24 CN disclosed
US-8092712-B2 Bent-core LC decorated gold nanoclusters Ridout & Maybee LLP (CA) 2012-01-10 US disclosed
US-20110062385-A1 BENT-CORE LC DECORATED GOLD NANOCLUSTERS UNIVERSITY OF MANITOBA (CA) 2011-03-17 US disclosed
US-7247384-B2 tip coated with a monolayer of ethylene glycol derivatives resists the adsorption of proteins THE UNIVERSITY OF HOUSTON (US) 2007-07-24 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110062385-A1 BENT-CORE LC DECORATED GOLD NANOCLUSTERS SLC6A13, SLC6A6, LGALS3 CES2 481/4885POLB 4468/4885BLM 2517/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.