SCHEMBL5855334

SCHEMBL5855334

CCCCCCCCCCCCCCCCCCCCCC(=O)ONC

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.57
LMNA P02545 2/20 0.53
PAM P19021 2/20 0.52
CNR2 P34972 1/20 0.51
CES2 O00748 3/20 0.50
CES1 P23141 3/20 0.50
MAPT P10636 2/20 0.50
MAPK1 P28482 1/20 0.50
TSHR P16473 4/20 0.48
HSP90AA1 P07900 1/20 0.48
PPARG P37231 4/20 0.48
PPARD Q03181 4/20 0.48
PPARA Q07869 4/20 0.48
GPR84 Q9NQS5 3/20 0.48
HDAC11 Q96DB2 3/20 0.48
ALDH1A1 P00352 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
SLC22A6 Q4U2R8 1/20 0.48
SLC22A8 Q8TCC7 1/20 0.48
TLR2 O60603 1/20 0.48

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
SCHEMBL28254271 1.00 DGKA (0.57) DGKALMNAPAMCNR2CES2
SCHEMBL27460695 1.00 DGKA (0.57) DGKALMNAPAMCNR2CES2
SCHEMBL8128698 1.00 DGKA (0.57) DGKALMNAPAMCNR2CES2
SCHEMBL8393818 1.00 DGKA (0.57) DGKALMNAPAMCNR2CES2
SCHEMBL27290608 1.00 DGKA (0.57) DGKALMNAPAMCNR2CES2
SCHEMBL27363925 0.98 DGKA (0.55) DGKALMNAPAMCNR2CES2
SCHEMBL3630253 0.98 DGKA (0.54) DGKALMNAPAMCNR2CES2
Hydrochloric Acid SCHEMBL5779913 0.96 DGKA (0.52) DGKALMNAPAMCNR2CES2
SCHEMBL10411539 0.96 DGKA (0.52) DGKALMNAPAMCNR2CES2
SCHEMBL11898443 0.91

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7101954-B2 Polymeric urethane ester quats and their use in personal care compositions ALZO INTERNATIONAL, INC. (US) 2006-09-05 US disclosed
US-6800716-B2 FOR USE IN COSMETIC AND/OR TOILETRY PRODUCT WHICH IS PREFERABLY USED ON OR IN CONTACT WITH THE HAIR, SKIN AND/OR NAILS ALZO INTERNATIONAL 2004-10-05 US disclosed