SCHEMBL13614065

SCHEMBL13614065

CCCC(=O)OC1CCCCO1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.44
SLC18A3 Q16572 1/20 0.42
ALDH1A1 P00352 2/20 0.38
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL8520097 0.95 NAAA (0.41) NAAASLC18A3ALDH1A1LMNAPOLB
SCHEMBL3346305 0.90 NAAA (0.53) NAAAMEN1KMT2ALMNAPOLB
SCHEMBL27564579 0.89 ALDH1A1 (0.43) NAAASLC18A3ALDH1A1
SCHEMBL6901495 0.89 NAAA (0.59) NAAA
SCHEMBL7172961 0.87 NAAA (0.62) NAAA
SCHEMBL10342906 0.87 NAAA (0.62) NAAA
SCHEMBL28466767 0.87 NAAA (0.62) NAAA
SCHEMBL20357987 0.86 CHRM2 (0.38) NAAAALDH1A1MEN1KMT2ALMNA
SCHEMBL3812571 0.86 CHRM2 (0.38) NAAAALDH1A1MEN1KMT2ALMNA
SCHEMBL26696399 0.85 NAAA (0.50) NAAALMNAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020118178-A1 MONOMETHYL FUMARATE-CARRIER CONJUGATES AND METHODS OF THEIR USE FLAGSHIP PIONEERING INNOVATIONS V, INC. (US) 2020-06-11 WO disclosed
WO-2016095088-A1 ERK INHIBITORS MERCK SHARP & DOHME CORP. (US) 2016-06-23 WO disclosed
EP-1538173-B1 Hydrogenated ring-opening metathesis polymer and process for producing the same MITSUI CHEMICALS INC (JP) 2009-11-04 EP disclosed
US-7435527-B2 Mixture of acid generator and resin insoluble in alkaline developer and another acid decomposable compound FUJIFILM CORPORATION (JP) 2008-10-14 US disclosed