SCHEMBL14286072

SCHEMBL14286072

CC(=O)C[C@H](C(N)=O)c1ccc(OCc2cccc(-c3ccc(C(F)(F)F)cc3)c2)cc1

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 12/20 0.66
▸ MRGPRX4 Q96LA9 1/20 0.50
▸ MAOB P27338 2/20 0.49
▸ AGXT P21549 1/20 0.49
▸ PPARD Q03181 3/20 0.48
▸ PPARA Q07869 2/20 0.48
▸ PPARG P37231 1/20 0.48
▸ PSEN1 P49768 1/20 0.47
▸ PSEN2 P49810 1/20 0.47
▸ APH1B Q8WW43 1/20 0.47
▸ NCSTN Q92542 1/20 0.47
▸ APH1A Q96BI3 1/20 0.47
▸ PSENEN Q9NZ42 1/20 0.47

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
SCHEMBL13118336 0.91 FFAR1 (0.76) FFAR1MRGPRX4MAOBAGXTPPARD
SCHEMBL12021108 0.90 FFAR1 (0.64) FFAR1MRGPRX4MAOBAGXTPPARD
SCHEMBL3520170 0.89 FFAR1 (0.62) FFAR1MRGPRX4MAOBAGXTPPARD
SCHEMBL14286071 0.85 FFAR1 (0.62) FFAR1MRGPRX4MAOBAGXTPPARD
SCHEMBL13550367 0.83 FFAR1 (0.74) FFAR1MRGPRX4MAOBAGXTPPARD
SCHEMBL13550323 0.83 FFAR1 (0.79) FFAR1MRGPRX4PPARDPPARAPPARG
SCHEMBL12191648 0.83 FFAR1 (0.86) FFAR1
SCHEMBL3519034 0.82 FFAR1 (0.60) FFAR1MRGPRX4MAOBAGXTPPARD
SCHEMBL13318210 0.82 FFAR1 (0.68) FFAR1MRGPRX4PPARDPPARAPPARG
SCHEMBL13550339 0.82 FFAR1 (0.74) FFAR1MRGPRX4PPARDPPARAPPARG

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
WO-2008030618-A1 BENZO-FUSED COMPOUNDS FOR USE IN TREATING METABOLIC DISORDERS AMGEN INC. (US) 2008-03-13 — — WO disclosed
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