SCHEMBL11340320

SCHEMBL11340320

CCCCCCOCCN(C(=O)C(=O)N(CCOCCCCCC)S(=O)(=O)C(F)(F)F)S(=O)(=O)C(F)(F)F

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CES2 O00748 6/20 0.47
CES1 P23141 7/20 0.41
ZDHHC20 Q5W0Z9 1/20 0.39
FAAH O00519 10/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
THRB P10828 1/20 0.39
HTT P42858 1/20 0.39
MAPT P10636 1/20 0.39
CYP1A2 P05177 1/20 0.38
HSD17B10 Q99714 1/20 0.38
PLA2G2C Q5R387 1/20 0.37

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
SCHEMBL11339864 0.81 CES2 (0.36) CES2CES1FAAHMEN1KMT2A
SCHEMBL11342089 0.77 CA1 (0.34) CES2CES1FAAH
SCHEMBL11219613 0.76 MLYCD (0.35)
SCHEMBL11342475 0.74 CES2 (0.44) CES2CES1FAAHMEN1KMT2A
SCHEMBL19853491 0.73 TSHR (0.39) CES2CES1FAAHMEN1KMT2A
SCHEMBL7861820 0.70 EPHX1 (0.46) CES2CES1FAAHMEN1KMT2A
SCHEMBL11335599 0.69
SCHEMBL11336374 0.69
Sulfuric Acid SCHEMBL8596252 0.69 MEN1 (0.60) CES2MEN1KMT2ATHRBHTT
Sulfuric Acid SCHEMBL9547095 0.69 MEN1 (0.60) CES2MEN1KMT2ATHRBHTT

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
EP-0010844-B1 NOVEL N,N'-BIS(TRIFLUOROMETHYLSULFONYL)OXAMIDES, CHEMILUMINESCENT COMPOSITIONS CONTAINING THEM AND PROCESSES FOR GENERATING CHEMILUMINESCENCE EMPLOYING SAID COMPOSITIONS AMERICAN CYANAMID COMPANY (US) 1981-10-07 EP disclosed
US-4288592-A Process for preparing amides by reaction in presence of molecular sieve AMERICAN CYANAMID COMPANY (US) 1981-09-08 US disclosed
US-4226738-A SUPERIOR LIGHT INTENSITY, QUANTUM EFFICIENT, AND LONG-LASTING AMERICAN CYANAMID COMPANY (US) 1980-10-07 US disclosed
EP-0010844-A1 Novel N,N'-bis(trifluoromethylsulfonyl)oxamides, chemiluminescent compositions containing them and processes for generating chemiluminescence employing said compositions AMERICAN CYANAMID COMPANY (US) 1980-05-14 EP disclosed