SCHEMBL6063686

SCHEMBL6063686

CCCC(=O)Oc1ccc(C(C)CO)cc1C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.49
LMNA P02545 2/20 0.40
ABCB11 O95342 1/20 0.40
KMT2A Q03164 5/20 0.39
GAA P10253 4/20 0.39
KDM4E B2RXH2 3/20 0.39
GLA P06280 2/20 0.39
ALDH1A1 P00352 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.37
HPGD P15428 1/20 0.36
MAPK1 P28482 1/20 0.36
HSD17B10 Q99714 1/20 0.36
BCL9 O00512 1/20 0.35
CTNNB1 P35222 1/20 0.35
FAAH O00519 1/20 0.35
ACHE P22303 3/20 0.35
BCHE P06276 2/20 0.35
AKR1B1 P15121 1/20 0.35
MEN1 O00255 1/20 0.35
RECQL P46063 1/20 0.35

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
SCHEMBL6063049 0.92 ALOX15 (0.47) ALOX15ABCB11KMT2AGAAKDM4E
SCHEMBL6063596 0.83 ALOX15 (0.44) ALOX15LMNAKMT2AGAAKDM4E
SCHEMBL6063385 0.80 ALOX15 (0.46) ALOX15KMT2AGAAKDM4EL3MBTL1
SCHEMBL22435385 0.77 ALOX15 (0.51) ALOX15LMNAKMT2AGAAKDM4E
SCHEMBL3837266 0.76 CYP1A2 (0.54) ALOX15LMNAKMT2AGAAKDM4E
SCHEMBL6063384 0.76 ALOX15 (0.43) ALOX15KMT2AGAAKDM4EAKR1B1
SCHEMBL10148396 0.75 ALDH1A1 (0.42) ALOX15LMNAKMT2AGAAKDM4E
SCHEMBL249211 0.75 TYR (0.56) ACHEBCHE
SCHEMBL27912614 0.74 ALOX15 (0.48) ALOX15LMNAKMT2AGAAKDM4E
SCHEMBL28449376 0.73 ALOX15 (0.49) ALOX15LMNAKMT2AGAAKDM4E

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-1680397-A2 NOVEL COMPOUNDS AND THEIR USE AS ANTIDIABETIC AND HYPOLIPIDEMIC AGENTS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Dr. Reddy's Laboratories Ltd. (IN) 2006-07-19 EP disclosed
WO-2005040102-A2 NOVEL COMPOUNDS AND THEIR USE AS ANTIDIABETIC AND HYPOLIPIDEMIC AGENTS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM DR. REDDY'S LABORATORIES LTD. (IN) 2005-05-06 WO disclosed