SCHEMBL27588149

SCHEMBL27588149

C=C(CCCCCCCCCCCC)C(=O)OCS(=O)(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.42
DGKA P23743 1/20 0.42
CES2 O00748 3/20 0.39
CES1 P23141 3/20 0.39
PAM P19021 2/20 0.39
GPR84 Q9NQS5 6/20 0.38
PPARG P37231 6/20 0.38
PPARD Q03181 6/20 0.38
PPARA Q07869 6/20 0.38
HDAC11 Q96DB2 5/20 0.38
ALDH1A1 P00352 2/20 0.38
TLR2 O60603 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
FABP4 P15090 2/20 0.38
PTPN1 P18031 2/20 0.38
SLC22A6 Q4U2R8 1/20 0.38
SLC22A8 Q8TCC7 1/20 0.38
MEN1 O00255 1/20 0.38
ESR1 P03372 1/20 0.38
ALOX15 P16050 1/20 0.38

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
SCHEMBL27843092 0.93 TSHR (0.37) TSHRDGKACES2CES1PAM
SCHEMBL6049037 0.84 TSHR (0.47) TSHRDGKACES2CES1PAM
Sulfuric Acid SCHEMBL27700571 0.82 TSHR (0.53) TSHRDGKACES2CES1PAM
SCHEMBL375675 0.80 FAAH (0.54) TSHRDGKACES2CES1GPR84
SCHEMBL375248 0.80 FAAH (0.54) TSHRDGKACES2CES1GPR84
SCHEMBL375247 0.80 FAAH (0.54) TSHRDGKACES2CES1GPR84
SCHEMBL3504005 0.80 FAAH (0.54) TSHRDGKACES2CES1GPR84
SCHEMBL374914 0.80 FAAH (0.54) TSHRDGKACES2CES1GPR84
SCHEMBL375026 0.80 FAAH (0.54) TSHRDGKACES2CES1GPR84
SCHEMBL65837 0.80 FAAH (0.54) TSHRDGKACES2CES1GPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1447831-A Stabilization of silicone or siloxane polymer compositions RHODIA CHIMIE SA (FR) 2003-10-08 CN disclosed