SCHEMBL11315674

SCHEMBL11315674

CC(C)C(C(=N)OCc1cccc(Oc2ccccc2)c1)c1ccc(OC(F)F)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 6/20 0.41
PPARG P37231 3/20 0.41
PPARA Q07869 3/20 0.41
MMP1 P03956 2/20 0.41
MRGPRX4 Q96LA9 1/20 0.41
MMP2 P08253 1/20 0.40
MMP9 P14780 1/20 0.40
MMP12 P39900 1/20 0.40
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
FFAR4 Q5NUL3 1/20 0.38
TDP1 Q9NUW8 2/20 0.37
LMNA P02545 1/20 0.37
ADRA2A P08913 1/20 0.37
CNR1 P21554 1/20 0.37
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PTGES O14684 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
SCHEMBL11318724 0.89 MMP1 (0.47) FFAR1MMP1MMP2MMP9MMP12
SCHEMBL4986942 0.88 FFAR1 (0.47) FFAR1PPARGPPARAMMP1MRGPRX4
SCHEMBL11307876 0.88 MMP1 (0.43) FFAR1MMP1MMP2MMP9MMP12
SCHEMBL11314664 0.86 LMNA (0.47) FFAR1PPARGPPARAMMP1MMP2
SCHEMBL11318424 0.85 CETP (0.46) FFAR1MMP1MRGPRX4MMP2MMP9
SCHEMBL11159854 0.81 PTGS1 (0.49) FFAR1PPARGPPARAMMP1MRGPRX4
SCHEMBL7935887 0.80 PPARG (0.42) FFAR1PPARGPPARAMRGPRX4KDM4E
SCHEMBL7935886 0.80 PPARG (0.42) FFAR1PPARGPPARAMRGPRX4KDM4E
SCHEMBL11452897 0.77 FFAR1 (0.49) FFAR1PPARGPPARAMMP1MRGPRX4
Hydrochloric Acid SCHEMBL9340358 0.76 MMP1 (0.48) FFAR1MMP1MMP2MMP9MMP12

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4288621-A Substituted 2,2-dimethylcyclopropaneamides ZOECON CORPORATION (US) 1981-09-08 US disclosed
US-4285879-A Cyclopropyl and phenylisobutylimidates ZOECON CORPORATION (US) 1981-08-25 US disclosed
US-4272449-A Phenoxy imidates ZOECON CORPORATION (US) 1981-06-09 US disclosed
US-4254264-A (6-Phenoxy-2-pyridyl) methyl esters of imidates ZOECON CORPORATION (US) 1981-03-03 US disclosed