SCHEMBL6049377

SCHEMBL6049377

FC(F)(F)COc1cccc(OCCC(Cl)I)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ GRIN1 Q05586 1/20 0.39
▸ GRIN2A Q12879 1/20 0.39
▸ GRIN2B Q13224 1/20 0.39
▸ GPR3 P46089 1/20 0.38
▸ CETP P11597 1/20 0.38
▸ DRD2 P14416 1/20 0.38
▸ DRD3 P35462 1/20 0.38
▸ CYP17A1 P05093 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ MEN1 O00255 2/20 0.37
▸ LMNA P02545 2/20 0.37
▸ HTT P42858 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ NPSR1 Q6W5P4 2/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ S1PR2 O95136 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
SCHEMBL6049337 0.85 L3MBTL1 (0.52) ALDH1A1LMNAHTTKMT2AL3MBTL1
SCHEMBL6049335 0.82 L3MBTL1 (0.39) ALDH1A1CETPLMNAHTTKMT2A
SCHEMBL6049352 0.80 KCNH2 (0.43) L3MBTL1
SCHEMBL10972329 0.80 MAPT (0.59) MAPTALDH1A1GRIN1GRIN2AGRIN2B
SCHEMBL6049333 0.78 CETP (0.38) CETPL3MBTL1PDK2
SCHEMBL26417174 0.74 TSHR (0.50) MAPTALDH1A1GPR3DRD2DRD3
SCHEMBL6049355 0.74 MAPK1 (0.42) ALDH1A1KMT2ASMN1; SMN2L3MBTL1KDM4E
SCHEMBL24305918 0.72 MAPK1 (0.55) MAPTALDH1A1GRIN1GRIN2AGRIN2B
SCHEMBL9458046 0.72 GPR3 (0.49) MAPTALDH1A1GRIN1GRIN2AGRIN2B
SCHEMBL2494479 0.72 MAOB (0.53) MAPTALDH1A1GRIN1GRIN2AGRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1539136-A4 PPAR ALPHA SELECTIVE COMPOUNDS FOR THE TREATMENT OF DYSLIPIDEMIA AND OTHER LIPID DISORDERS MERCK & CO INC (US) 2006-10-18 — — EP disclosed
EP-1539136-A2 PPAR ALPHA SELECTIVE COMPOUNDS FOR THE TREATMENT OF DYSLIPIDEMIA AND OTHER LIPID DISORDERS Merck & Co., Inc. (US) 2005-06-15 — — EP disclosed
WO-2004010936-A2 PPAR ALPHA SELECTIVE COMPOUNDS FOR THE TREATMENT OF DYSLIPIDEMIA AND OTHER LIPID DISORDERS MERCK & CO., INC. (US) 2004-02-05 — — WO disclosed
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