SCHEMBL9348758

SCHEMBL9348758

CCCCCCCC/C=C\CCCCCCCC(=O)OCC=CCOC(=O)CCCCCCC/C=C\CCCCCCCC

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.64
DGKA P23743 1/20 0.63
PRKCE Q02156 1/20 0.60
PRKCQ Q04759 1/20 0.60
PRKCD Q05655 1/20 0.60
PRKCA P17252 1/20 0.60
TERT O14746 3/20 0.59
PTPN1 P18031 3/20 0.59
PPARG P37231 3/20 0.59
PPARD Q03181 3/20 0.59
PPARA Q07869 3/20 0.59
FAAH O00519 3/20 0.59
CYP1A2 P05177 2/20 0.59
MAPT P10636 2/20 0.59
CYP2C19 P33261 2/20 0.59
BLM P54132 2/20 0.59
HSD17B10 Q99714 2/20 0.59
FABP4 P15090 2/20 0.59
KMT2A Q03164 2/20 0.59
GMNN O75496 1/20 0.59

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
SCHEMBL29119147 1.00 TSHR (0.64) TSHRDGKAPRKCEPRKCQPRKCD
SCHEMBL28936532 1.00 TSHR (0.64) TSHRDGKAPRKCEPRKCQPRKCD
SCHEMBL30592524 1.00 TSHR (0.64) TSHRDGKAPRKCEPRKCQPRKCD
SCHEMBL10084760 1.00 TSHR (0.64) TSHRDGKAPRKCEPRKCQPRKCD
SCHEMBL15027037 1.00 TSHR (0.64) TSHRDGKAPRKCEPRKCQPRKCD
SCHEMBL31203100 1.00 TSHR (0.64) TSHRDGKAPRKCEPRKCQPRKCD
SCHEMBL29119174 1.00 TSHR (0.64) TSHRDGKAPRKCEPRKCQPRKCD
SCHEMBL15027031 1.00 TSHR (0.64) TSHRDGKAPRKCEPRKCQPRKCD
SCHEMBL9348765 1.00 TSHR (0.64) TSHRDGKAPRKCEPRKCQPRKCD
SCHEMBL29269579 1.00 TSHR (0.64) TSHRDGKAPRKCEPRKCQPRKCD

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
US-5286512-A Fatty diester of dihydric alcohol NABISCO, INC. (US) 1994-02-15 US disclosed
EP-0405874-A1 Diol lipid analogues as edible fat replacements NABISCO, INC. (US) 1991-01-02 EP disclosed
US-4144256-A FATTY AMIDE SUBSTITUTED WITH ACETYLTHIO GROUP OR GROUPS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 1979-03-13 US disclosed
US-4062841-A MICROBIOCIDE THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 1977-12-13 US disclosed