SCHEMBL28016992

SCHEMBL28016992

O=C(O)CCCCCCCC(=O)OOC(=O)CCCCCCCC(=O)O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.67
LMNA P02545 3/20 0.67
NFKB1 P19838 1/20 0.67
PMP22 Q01453 1/20 0.67
GPR84 Q9NQS5 8/20 0.55
FFAR1 O14842 2/20 0.55
FFAR4 Q5NUL3 2/20 0.55
SLC22A6 Q4U2R8 2/20 0.53
PPARG P37231 6/20 0.52
PPARD Q03181 6/20 0.52
PPARA Q07869 6/20 0.52
HDAC11 Q96DB2 5/20 0.52
ALDH1A1 P00352 3/20 0.52
TLR2 O60603 2/20 0.52
TDP1 Q9NUW8 2/20 0.52
MEN1 O00255 2/20 0.52
FABP4 P15090 2/20 0.52
ALOX15 P16050 2/20 0.52
PTPN1 P18031 2/20 0.52
KMT2A Q03164 2/20 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
SCHEMBL11428551 1.00 TSHR (0.67) TSHRLMNANFKB1PMP22GPR84
SCHEMBL11430441 1.00 TSHR (0.67) TSHRLMNANFKB1PMP22GPR84
SCHEMBL11438083 0.97 LMNA (0.65) TSHRLMNANFKB1PMP22GPR84
SCHEMBL312723 0.92 SLC22A6 (0.65) TSHRLMNANFKB1PMP22GPR84
SCHEMBL11524123 0.91 TSHR (0.55) TSHRLMNANFKB1PMP22GPR84
SCHEMBL23581666 0.90 TSHR (0.60) TSHRLMNANFKB1PMP22GPR84
SCHEMBL1963536 0.89 GPR84 (0.74) TSHRLMNAGPR84FFAR1FFAR4
Decanoic Acid SCHEMBL2497216 0.89 GPR84 (0.74) TSHRLMNAGPR84FFAR1FFAR4
SCHEMBL11909096 0.89 GPR84 (0.54) TSHRLMNANFKB1PMP22GPR84
Octanoic Acid SCHEMBL2494274 0.89 GPR84 (0.74) TSHRLMNAGPR84FFAR1FFAR4

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-104789371-A Novel antistatic washing powder for chemical fiber fabric and preparation method of novel antistatic washing powder Huzhou jiangnan hengsheng refining and dyeing co ltd 2015-07-22 CN disclosed