SCHEMBL8064431

SCHEMBL8064431

CSCCCCCCCCCC(=O)O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.60
LMNA P02545 2/20 0.60
NFKB1 P19838 1/20 0.60
PMP22 Q01453 1/20 0.60
GPR84 Q9NQS5 8/20 0.54
PPARG P37231 7/20 0.54
PPARD Q03181 7/20 0.54
PPARA Q07869 7/20 0.54
HDAC11 Q96DB2 5/20 0.54
PTPN1 P18031 3/20 0.54
ALDH1A1 P00352 2/20 0.54
TLR2 O60603 2/20 0.54
TDP1 Q9NUW8 2/20 0.54
FABP4 P15090 2/20 0.54
FFAR1 O14842 2/20 0.54
FFAR4 Q5NUL3 2/20 0.54
SLC22A6 Q4U2R8 1/20 0.54
SLC22A8 Q8TCC7 1/20 0.54
MEN1 O00255 1/20 0.54
ESR1 P03372 1/20 0.54

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
SCHEMBL9340793 1.00 TSHR (0.60) TSHRLMNANFKB1PMP22GPR84
SCHEMBL849456 1.00 TSHR (0.60) TSHRLMNANFKB1PMP22GPR84
SCHEMBL17323034 1.00 TSHR (0.60) TSHRLMNANFKB1PMP22GPR84
SCHEMBL8161852 1.00 TSHR (0.60) TSHRLMNANFKB1PMP22GPR84
SCHEMBL4003102 1.00 TSHR (0.60) TSHRLMNANFKB1PMP22GPR84
SCHEMBL20378734 1.00 TSHR (0.60) TSHRLMNANFKB1PMP22GPR84
SCHEMBL2554930 0.97
SCHEMBL154914 0.90
Ammonia Solution, Strong SCHEMBL27490384 0.87
Methyl Alcohol SCHEMBL28865919 0.87 TSHR (0.56) TSHRLMNANFKB1PMP22GPR84

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
EP-1021551-A1 PLANT FATTY ACID HYDROXYLASE GENES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2000-07-26 EP disclosed
WO-1999018224-A1 PLANT FATTY ACID HYDROXYLASE GENES THE CENTRE NATIONAL DE RECHERCHE SCIENTIFIQUE (US) 1999-04-15 WO disclosed