SCHEMBL3666874

SCHEMBL3666874

CN(Cc1cccc(-c2cc(C(F)(F)F)ccc2[O])c1)C(=O)Oc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ABHD6 Q9BV23 2/20 0.54
LIPE Q05469 1/20 0.52
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
TACR1 P25103 5/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
MGLL Q99685 1/20 0.43
MTOR P42345 1/20 0.42
AOC3 Q16853 2/20 0.41
PTGDR2 Q9Y5Y4 2/20 0.41
HSD17B2 P37059 1/20 0.39
PPARG P37231 2/20 0.39
PPARA Q07869 2/20 0.39
CYP2C9 P11712 1/20 0.39
KCNH2 Q12809 1/20 0.39

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
SCHEMBL3666876 0.90 ABHD6 (0.54) ABHD6LIPEKDM4EALDH1A1TACR1
SCHEMBL1950749 0.85 PTGDR2 (0.62) ABHD6LIPEPTGDR2
SCHEMBL3671898 0.85 LIPE (0.46) ABHD6LIPEKDM4EALDH1A1TACR1
SCHEMBL3671609 0.84 MLYCD (0.52) TACR1MEN1KMT2AMTORAOC3
SCHEMBL3667568 0.82 MGLL (0.42) ABHD6LIPEKDM4EALDH1A1TACR1
SCHEMBL3668636 0.82 MTOR (0.64) TACR1MEN1KMT2AMGLLMTOR
SCHEMBL3666865 0.78 HDAC6 (0.56) TACR1MEN1KMT2APTGDR2
SCHEMBL12542896 0.77 PTGDR2 (0.52) ABHD6LIPEMGLLPTGDR2PPARG
SCHEMBL3665166 0.77 TACR1 (0.47) ABHD6LIPETACR1MEN1KMT2A
SCHEMBL3672476 0.76 MTOR (0.43) ALDH1A1TACR1MTORAOC3PTGDR2

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-2240434-A1 2-PHENYL PHENOXYACETIC ACIDS USEFUL FOR TREATING INFLAMMATORY DISORDERS Ligand Pharmaceuticals Inc. (US) 2010-10-20 EP disclosed
WO-2009089192-A1 2-PHENYL PHENOXYACETIC ACIDS USEFUL FOR TREATING INFLAMMATORY DISORDERS LIGAND PHARMACEUTICALS INC. (US) 2009-07-16 WO disclosed