SCHEMBL28077244

SCHEMBL28077244

CCCCCCOC(=O)C(CCC)(CCC)C(=O)OC

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.49
NAAA Q02083 2/20 0.47
FAAH O00519 1/20 0.44
ACHE P22303 6/20 0.43
TSHR P16473 3/20 0.43
HCAR2 Q8TDS4 1/20 0.41
RAD52 P43351 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
ATM Q13315 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40

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
SCHEMBL28134686 0.93 NAAA (0.53) EPHX1NAAAFAAHACHETSHR
SCHEMBL27435100 0.89 EPHX1 (0.52) EPHX1NAAAFAAHACHETSHR
SCHEMBL27909007 0.89 NAAA (0.48) EPHX1NAAAFAAHACHETSHR
SCHEMBL28556796 0.85 NAAA (0.53) EPHX1NAAAFAAHACHETSHR
SCHEMBL7772430 0.85 NAAA (0.53) EPHX1NAAAFAAHACHETSHR
SCHEMBL11219084 0.85 NAAA (0.53) EPHX1NAAAFAAHACHETSHR
SCHEMBL28563002 0.85 NAAA (0.53) EPHX1NAAAFAAHACHETSHR
SCHEMBL27908938 0.85 MEN1 (0.39) ACHETSHRHCAR2NPSR1MEN1
SCHEMBL28289556 0.85 ALDH1A1 (0.52) EPHX1NAAAACHETSHRHCAR2
SCHEMBL21202214 0.85 MEN1 (0.58) EPHX1NAAAFAAHACHETSHR

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
CN-105837714-A METHOD FOR PRODUCING SOLID CATALYST COMPONENT FOR USE IN POLYMERIZATION OF OLEFIN, CATALYST FOR USE IN POLYMERIZATION OF OLEFIN, AND METHOD FOR PRODUCING OLEFIN POLYMER 东邦钛株式会社 2016-08-10 CN disclosed