SCHEMBL8853002

SCHEMBL8853002

CCCCCCC(=COC=C(CCCCCC)OCC)OCC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.43
DGKA P23743 1/20 0.41
TSHR P16473 5/20 0.39
CES2 O00748 3/20 0.38
CES1 P23141 3/20 0.38
PAM P19021 2/20 0.37
GPR84 Q9NQS5 6/20 0.37
PPARG P37231 6/20 0.37
PPARD Q03181 6/20 0.37
PPARA Q07869 6/20 0.37
HDAC11 Q96DB2 5/20 0.37
ALDH1A1 P00352 2/20 0.37
TLR2 O60603 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
FABP4 P15090 2/20 0.37
PTPN1 P18031 2/20 0.37
SLC22A6 Q4U2R8 1/20 0.37
SLC22A8 Q8TCC7 1/20 0.37
MEN1 O00255 1/20 0.37
ESR1 P03372 1/20 0.37

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
SCHEMBL8069698 0.83 FAAH (0.46) FAAHDGKATSHRCES2CES1
SCHEMBL28218359 0.78 FAAH (0.50) FAAHDGKAPPARGPPARDPPARA
SCHEMBL11857022 0.78 FAAH (0.46) FAAHDGKATSHRCES2CES1
Octane SCHEMBL10672069 0.75 FAAH (0.47) FAAHDGKATSHRPAMGPR84
SCHEMBL10672206 0.75 FAAH (0.47) FAAHDGKATSHRPAMGPR84
SCHEMBL8853169 0.74 LMNA (0.40) FAAHDGKACES2CES1ALDH1A1
Octane SCHEMBL10672248 0.73 FAAH (0.46) FAAHDGKATSHRPAMGPR84
SCHEMBL17355050 0.73 FAAH (0.36) FAAHDGKATSHRCES2CES1
SCHEMBL9680040 0.73 CES1 (0.44) FAAHDGKATSHRCES2CES1
Octane SCHEMBL10666738 0.72 FAAH (0.45) FAAHDGKATSHRPAMGPR84

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
US-5672675-A Vinyl ether-terminated polyester oligomer stabilizers for vinyl ether-based coating systems ALLIEDSIGNAL, INC. (US) 1997-09-30 US disclosed
US-5514727-A OPTICAL FIBER COATINGS, POLYETHER OR POLYESTER POLYOLS ENDCAPPED WITH HYDROXY VINYL ETHER ALLIEDSIGNAL INC. (US) 1996-05-07 US disclosed