SCHEMBL1948715

SCHEMBL1948715

C=CC(=O)OC(CCC)(CCCCCC/C=C\C/C=C\CCCCC)C(N)=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.50
SOAT1 P35610 2/20 0.50
CNR1 P21554 1/20 0.48
ALDH1A1 P00352 5/20 0.43
PPARG P37231 5/20 0.43
F7 P08709 4/20 0.43
F3 P13726 4/20 0.43
PPARD Q03181 4/20 0.43
PPARA Q07869 4/20 0.43
CYP3A4 P08684 3/20 0.43
FABP3 P05413 3/20 0.43
FFAR1 O14842 3/20 0.43
LMNA P02545 2/20 0.43
CYP19A1 P11511 2/20 0.43
FABP4 P15090 2/20 0.43
HPGD P15428 2/20 0.43
ALOX15 P16050 2/20 0.43
PTGS1 P23219 2/20 0.43
AKR1C3 P42330 2/20 0.43
NR4A2 P43354 2/20 0.43

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
SCHEMBL1949921 0.96 FAAH (0.46) KDM4ESOAT1CNR1PPARGF7
SCHEMBL1949924 0.96 FAAH (0.46) KDM4ESOAT1CNR1PPARGF7
SCHEMBL1950682 0.96 FAAH (0.46) KDM4ESOAT1CNR1PPARGF7
SCHEMBL1950052 0.96 FAAH (0.46) KDM4ESOAT1CNR1PPARGF7
SCHEMBL1950681 0.96 FAAH (0.46) KDM4ESOAT1CNR1PPARGF7
SCHEMBL1953129 0.91 TSHR (0.41) KDM4ESOAT1ALDH1A1CYP3A4HPGD
SCHEMBL1953132 0.91 TSHR (0.41) KDM4ESOAT1ALDH1A1CYP3A4HPGD
SCHEMBL1951436 0.91 TSHR (0.41) KDM4ESOAT1ALDH1A1CYP3A4HPGD
SCHEMBL1948608 0.88 FAAH (0.46) KDM4ESOAT1CNR1PPARGF7
SCHEMBL1949873 0.88 FAAH (0.46) KDM4ESOAT1CNR1PPARGF7

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
US-20110136975-A1 MONOMER MIXTURE, POLYMER, COATING MEANS AND METHOD FOR PRODUCING A COATING EVONIK ROEHM GMBH (DE) 2011-06-09 US disclosed