SCHEMBL20428709

SCHEMBL20428709

COOC(=O)CC1CCCCC1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.43
KMT2A Q03164 2/20 0.42
EPHX1 P07099 1/20 0.42
HPGD P15428 1/20 0.42
EPHX2 P34913 1/20 0.41
LMNA P02545 1/20 0.39
L3MBTL1 Q9Y468 3/20 0.39
TDP1 Q9NUW8 1/20 0.39
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 1/20 0.37
MAPT P10636 1/20 0.37
TSHR P16473 1/20 0.37
HSD17B10 Q99714 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
SCHEMBL4189908 0.84 KMT2A (0.45) POLBKMT2AEPHX1HPGDEPHX2
SCHEMBL8099254 0.83 KMT2A (0.50) POLBKMT2AEPHX1HPGDEPHX2
SCHEMBL106265 0.83 KMT2A (0.50) POLBKMT2AEPHX1HPGDEPHX2
SCHEMBL14606391 0.83 KMT2A (0.50) POLBKMT2AEPHX1HPGDEPHX2
SCHEMBL18322599 0.83 KMT2A (0.50) POLBKMT2AEPHX1HPGDEPHX2
SCHEMBL868953 0.80 BRD4 (0.47) POLBKMT2AEPHX1HPGDEPHX2
SCHEMBL11342867 0.80 L3MBTL1 (0.40) POLBKMT2AEPHX1HPGDLMNA
SCHEMBL22534506 0.78 KMT2A (0.45) POLBKMT2AEPHX1HPGDEPHX2
SCHEMBL6321838 0.78 EPHX1 (0.48) POLBKMT2AEPHX1HPGDEPHX2
SCHEMBL13618451 0.78 L3MBTL1 (0.44) POLBKMT2AEPHX1HPGDEPHX2

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
EP-2862856-B1 IMIDAZOLE AND TRIAZOLE COMPOUNDS AS DGAT-1 INHIBITORS MITSUBISHI TANABE PHARMA CORP (JP) 2018-08-01 EP disclosed