SCHEMBL3264693

SCHEMBL3264693

CCC(Cc1ccc(OC)c(F)c1)C(=O)c1ccc(OC)cc1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PPARD Q03181 10/20 0.51
▸ PPARA Q07869 10/20 0.51
▸ PPARG P37231 8/20 0.49
▸ TAS2R14 Q9NYV8 1/20 0.49
▸ LMNA P02545 2/20 0.49
▸ HTT P42858 2/20 0.49
▸ NPC1 O15118 1/20 0.49
▸ MAPK1 P28482 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ EPHX2 P34913 1/20 0.46

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
SCHEMBL1346881 0.79 LMNA (0.76) TAS2R14LMNAHTTNPC1MAPK1
SCHEMBL3235287 0.78 LDHA (0.44) PPARDPPARATAS2R14LMNAHTT
SCHEMBL7639644 0.77 HTT (0.58) PPARGLMNAHTT
SCHEMBL1347457 0.77 HTT (0.68) TAS2R14LMNAHTTNPC1MAPK1
SCHEMBL1346076 0.74 TAS2R14 (0.46) TAS2R14LMNAHTTNPC1EPHX2
SCHEMBL3262036 0.72 ADRB3 (0.43) —
SCHEMBL3940426 0.72 HTT (0.61) LMNAHTTNPC1MAPK1RAB9A
SCHEMBL6441737 0.71 ALDH1A1 (0.73) LMNAHTTNPC1MAPK1RAB9A
SCHEMBL13003651 0.71 ALOX15 (0.46) HTT
SCHEMBL11218889 0.71 ALOX15 (0.46) HTT

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-2010030787-A1 ESTROGEN RECEPTOR LIGANDS RADIUS HEALTH, INC. (US) 2010-03-18 — — WO disclosed
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