SCHEMBL10815671

SCHEMBL10815671

COC(=O)CCCCCCCOc1nc(-c2ccccc2)c(-c2ccccc2)n1-c1ccc(OC)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 7/20 0.52
▸ LTB4R Q15722 2/20 0.47
▸ PPARG P37231 1/20 0.43
▸ FABP3 P05413 1/20 0.43
▸ FABP4 P15090 1/20 0.43
▸ HDAC3 O15379 3/20 0.42
▸ HDAC4 P56524 3/20 0.42
▸ HDAC1 Q13547 3/20 0.42
▸ HDAC7 Q8WUI4 3/20 0.42
▸ HDAC2 Q92769 3/20 0.42
▸ HDAC10 Q969S8 3/20 0.42
▸ HDAC11 Q96DB2 3/20 0.42
▸ HDAC8 Q9BY41 3/20 0.42
▸ HDAC6 Q9UBN7 3/20 0.42
▸ HDAC9 Q9UKV0 3/20 0.42
▸ HDAC5 Q9UQL6 3/20 0.42
▸ ALDH1A1 P00352 4/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ USP2 O75604 2/20 0.41

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
SCHEMBL10811110 0.96 FAAH (0.49) FAAHLTB4RPPARGHDAC3HDAC4
SCHEMBL10814504 0.93 FAAH (0.56) FAAHLTB4RHDAC3HDAC4HDAC1
SCHEMBL10818300 0.93 FAAH (0.56) FAAHLTB4RHDAC3HDAC4HDAC1
SCHEMBL11058331 0.93 FAAH (0.56) FAAHLTB4RHDAC3HDAC4HDAC1
SCHEMBL10812727 0.92 LTB4R (0.53) FAAHLTB4RPPARGFABP3FABP4
SCHEMBL10816580 0.91 FAAH (0.53) FAAHLTB4RHDAC3HDAC4HDAC1
SCHEMBL11056903 0.91 LTB4R (0.52) FAAHLTB4RPPARGFABP3FABP4
SCHEMBL10813329 0.90 FAAH (0.52) FAAHLTB4RFABP3FABP4MAPT
SCHEMBL11056892 0.89 LTB4R (0.43) FAAHLTB4RPPARGFABP3FABP4
SCHEMBL11059270 0.88 FAAH (0.53) FAAHLTB4RFABP3FABP4ALDH1A1

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-0104342-B1 TRIPHENYLIMIDAZOLYLOXYALCANOIC ACIDS AND THEIR DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM A. Nattermann & Cie. GmbH (DE) 1987-01-28 — — EP disclosed
US-4460598-A Triphenylimidazolyloxyalkanoic acids and their derivatives and a process for the treatment of thromboembolic, inflammatory and/or atheriosclerotic diseases A. NATTERMANN & CIE GMBH (DE) 1984-07-17 — — US disclosed
EP-0104342-A1 Triphenylimidazolyloxyalcanoic acids and their derivatives, process for their preparation and pharmaceutical compositions containing them A. Nattermann & Cie. GmbH (DE) 1984-04-04 — — EP disclosed
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