Hexadecanoic Acid Methyl Ester

Hexadecanoic Acid Methyl Ester

SCHEMBL27975111

CCCCCCCCCCCCCCCC(=O)OC.c1ccc(-c2ccccc2)cc1

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.56
LTB4R Q15722 1/20 0.56
PPARA Q07869 1/20 0.55
SOAT1 P35610 2/20 0.54
POLB P06746 1/20 0.54
FAAH O00519 1/20 0.52
CES2 O00748 1/20 0.51
CES1 P23141 1/20 0.51
EPHX2 P34913 1/20 0.51
LMNA P02545 1/20 0.51
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
HDAC3 O15379 3/20 0.49
HDAC4 P56524 3/20 0.49
HDAC1 Q13547 3/20 0.49
HDAC7 Q8WUI4 3/20 0.49
HDAC2 Q92769 3/20 0.49
HDAC10 Q969S8 3/20 0.49
HDAC11 Q96DB2 3/20 0.49
HDAC8 Q9BY41 3/20 0.49

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
Biphenyl SCHEMBL27974824 1.00 PPARG (0.56) PPARGLTB4RPPARASOAT1POLB
Biphenyl SCHEMBL28796162 1.00 PPARG (0.56) PPARGLTB4RPPARASOAT1POLB
Biphenyl SCHEMBL27861772 1.00 PPARG (0.56) PPARGLTB4RPPARASOAT1POLB
Methyl Tetradecanoate SCHEMBL28796204 1.00 PPARG (0.56) PPARGLTB4RPPARASOAT1POLB
Biphenyl SCHEMBL27297957 0.98 POLB (0.55) PPARGLTB4RPPARASOAT1POLB
Biphenyl SCHEMBL27531294 0.93 KDM4E (0.53) PPARGLTB4RPPARAPOLBFAAH
Benzene SCHEMBL27504487 0.89 TSHR (0.58) PPARGPPARAPOLBMEN1KMT2A
Benzene SCHEMBL27540068 0.89 TSHR (0.58) PPARGPPARAPOLBMEN1KMT2A
Hexadecanoic Acid Methyl Ester SCHEMBL18338704 0.89 PPARG (0.52) PPARGLTB4RPPARASOAT1POLB
Hexadecanoic Acid Methyl Ester SCHEMBL28769776 0.88 PPARG (0.54) PPARGPPARAPOLBCES2CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105143367-A Solid writing material PILOT CORP 2015-12-09 CN disclosed
CN-102575123-B Reversibly thermochromic aqueous ink composition, and writing instrument and writing instrument set each utilizing same PILOT INK CO LTD 2015-01-07 CN disclosed
CN-103998569-A Reversibly thermochromic composition PILOT CORP 2014-08-20 CN disclosed