SCHEMBL11270109

SCHEMBL11270109

C=C(CCCCC)C(=O)C(=C)CCCCC

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 5/20 0.55
CES1 P23141 4/20 0.55
AKR1B1 P15121 1/20 0.52
GPR84 Q9NQS5 7/20 0.50
PPARG P37231 7/20 0.50
PPARD Q03181 7/20 0.50
PPARA Q07869 7/20 0.50
HDAC11 Q96DB2 5/20 0.50
TSHR P16473 4/20 0.50
PTPN1 P18031 3/20 0.50
ALDH1A1 P00352 2/20 0.50
TLR2 O60603 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
FABP4 P15090 2/20 0.50
SLC22A6 Q4U2R8 1/20 0.50
SLC22A8 Q8TCC7 1/20 0.50
MEN1 O00255 1/20 0.50
ESR1 P03372 1/20 0.50
ALOX15 P16050 1/20 0.50
PDE4A P27815 1/20 0.50

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
SCHEMBL8719599 0.97 CES2 (0.56) CES2CES1AKR1B1GPR84PPARG
SCHEMBL11511121 0.97 CES2 (0.56) CES2CES1AKR1B1GPR84PPARG
SCHEMBL182418 0.97 CES2 (0.56) CES2CES1AKR1B1GPR84PPARG
SCHEMBL182305 0.92 CES1 (0.52) CES2CES1AKR1B1GPR84PPARG
SCHEMBL9280180 0.88 AKR1B1 (0.52) CES2CES1AKR1B1GPR84PPARG
SCHEMBL2688227 0.83 CES2 (0.50) CES2CES1AKR1B1GPR84PPARG
SCHEMBL8436673 0.82 CES1 (0.67) CES2CES1AKR1B1GPR84PPARG
SCHEMBL6910249 0.82 AKR1B1 (0.56) CES2CES1AKR1B1GPR84PPARG
SCHEMBL22545 0.82 AKR1B1 (0.56) CES2CES1AKR1B1GPR84PPARG
SCHEMBL3505390 0.82 CES1 (0.52) CES2CES1AKR1B1GPR84PPARG

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
CN-118160078-A Resin, insulating film, and organic field effect transistor device including the same 东曹株式会社 2024-06-07 CN disclosed
US-4379827-A Imaging structure with tellurium metal film and energy sensitive material thereon ENERGY CONVERSION DEVICES, INC. (US) 1983-04-12 US disclosed