SCHEMBL7943705

SCHEMBL7943705

CCCCCOC(=O)C(C)(C)C(=O)OCCCCC

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.54
EPHX1 P07099 1/20 0.50
TSHR P16473 4/20 0.48
ALDH1A1 P00352 2/20 0.48
HCAR2 Q8TDS4 2/20 0.47
TP53 P04637 1/20 0.46
CYP3A4 P08684 1/20 0.46
MAPK1 P28482 1/20 0.46
RAD52 P43351 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
ATM Q13315 1/20 0.45
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA9 Q16790 1/20 0.45
FAAH O00519 1/20 0.44
LMNA P02545 1/20 0.44
ACHE P22303 4/20 0.44

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
SCHEMBL12232762 0.98 NAAA (0.57) NAAAEPHX1TSHRALDH1A1HCAR2
SCHEMBL7947115 0.98 NAAA (0.57) NAAAEPHX1TSHRALDH1A1HCAR2
SCHEMBL7943712 0.98 NAAA (0.57) NAAAEPHX1TSHRALDH1A1HCAR2
SCHEMBL7936152 0.98 NAAA (0.57) NAAAEPHX1TSHRALDH1A1HCAR2
SCHEMBL6058509 0.93 ALDH1A1 (0.56) NAAAEPHX1TSHRALDH1A1HCAR2
SCHEMBL28947501 0.90 NAAA (0.48) NAAAEPHX1TSHRALDH1A1HCAR2
SCHEMBL12749791 0.90 TSHR (0.48) NAAAEPHX1TSHRALDH1A1HCAR2
SCHEMBL10515804 0.88 NAAA (0.52) NAAAEPHX1TSHRALDH1A1HCAR2
SCHEMBL14566016 0.88 NAAA (0.52) NAAAEPHX1TSHRALDH1A1HCAR2
SCHEMBL9153319 0.88 NAAA (0.52) NAAAEPHX1TSHRALDH1A1HCAR2

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-2636688-A1 METHOD FOR PRODUCING SOLID CATALYST COMPONENT FOR OLEFIN POLYMERIZATION, CATALYST FOR OLEFIN POLYMERIZATION, AND OLEFIN POLYMERS Toho Titanium Co., Ltd. (JP) 2013-09-11 EP disclosed
US-6331620-B1 AS POLYMERIZATION CATALYSTS FOR PRODUCING STEREOSPECIFIC HOMOPOLYMER OR COPOLYMER OF ALPHA-OLEFINS IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2001-12-18 US disclosed