SCHEMBL7614009

SCHEMBL7614009

CCCCCCCC(=O)C(Cl)(C(=O)CCCCCCC)C(=O)CCCCCCC

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 8/20 0.61
CES1 P23141 8/20 0.61
CES2 O00748 5/20 0.61
MEN1 O00255 2/20 0.61
KMT2A Q03164 2/20 0.61
HSD17B10 Q99714 2/20 0.61
CYP1A2 P05177 1/20 0.61
TSHR P16473 4/20 0.56
ALDH1A1 P00352 3/20 0.56
PPARG P37231 4/20 0.52
PPARD Q03181 4/20 0.52
PPARA Q07869 4/20 0.52
GPR84 Q9NQS5 3/20 0.52
HDAC11 Q96DB2 3/20 0.52
TDP1 Q9NUW8 2/20 0.52
SLC22A6 Q4U2R8 1/20 0.52
SLC22A8 Q8TCC7 1/20 0.52
TLR2 O60603 1/20 0.52
ESR1 P03372 1/20 0.52
FABP4 P15090 1/20 0.52

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
SCHEMBL28055566 1.00 FAAH (0.61) FAAHCES1CES2MEN1KMT2A
SCHEMBL9568273 0.86 FAAH (0.61) FAAHCES1CES2MEN1KMT2A
SCHEMBL26124164 0.84 FAAH (0.59) FAAHCES1CES2MEN1KMT2A
SCHEMBL27557547 0.84 FAAH (0.59) FAAHCES1CES2MEN1KMT2A
SCHEMBL7028971 0.84 FAAH (0.59) FAAHCES1CES2MEN1KMT2A
SCHEMBL1723737 0.83 FAAH (0.60) FAAHCES1CES2MEN1KMT2A
Ammonia Solution, Strong SCHEMBL341116 0.82 FAAH (0.57) FAAHCES1CES2MEN1KMT2A
SCHEMBL10715041 0.79 FAAH (0.56) FAAHCES1CES2MEN1KMT2A
SCHEMBL11862399 0.79 FAAH (0.56) FAAHCES1CES2MEN1KMT2A
Dimethylamine SCHEMBL5538214 0.79 FAAH (0.53) FAAHCES1CES2MEN1KMT2A

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-0958266-B1 PROCESS FOR THE MANUFACTURE OF HALOCARBONS DU PONT (US) 2002-04-10 EP disclosed
US-6255544-B1 REACTING A HALOGENATED ALKANE WITH AN OLEFIN IN DINITRILE OR CYCLIC CARBONATE ESTER SOLVENT IN THE PRESENCE OF A CATALYST SYSTEM CONTAINING A MONOVALENT COPPER, AN IONIC PROMOTER OF AMMONIUM HALIDES, PYRIDINIUM HALIDES, OR QUATERNARY SALTS E. I. DU PONT DE NEMOURS AND COMPANY 2001-07-03 US disclosed
EP-0958266-A1 PROCESS FOR THE MANUFACTURE OF HALOCARBONS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1999-11-24 EP disclosed
WO-1998031649-A1 PROCESS FOR THE MANUFACTURE OF HALOCARBONS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1998-07-23 WO disclosed