SCHEMBL1201274

SCHEMBL1201274

CCCCC(CC)COP(O)(=S)SCC(CC)CCCC.[Zn]

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 6/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
TSHR P16473 4/20 0.40
TDP1 Q9NUW8 2/20 0.40
ATM Q13315 1/20 0.40
ALDH1A1 P00352 7/20 0.38
CA2 P00918 3/20 0.35
RECQL P46063 1/20 0.34
LMNA P02545 2/20 0.33
MMP9 P14780 1/20 0.33
MMP8 P22894 1/20 0.33
MMP14 P50281 1/20 0.33
MAPK1 P28482 1/20 0.32
HSD17B10 Q99714 1/20 0.32
LPAR2 Q9HBW0 3/20 0.32
LPAR3 Q9UBY5 3/20 0.32

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
SCHEMBL1150112 0.98 CYP3A4 (0.51) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL3781027 0.97 CYP3A4 (0.50) CYP3A4L3MBTL1TSHRTDP1ATM
Water SCHEMBL27627263 0.97 CYP3A4 (0.50) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL27082392 0.90 CYP3A4 (0.49) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL3974699 0.88 CYP3A4 (0.42) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL28790902 0.88 CYP3A4 (0.53) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL9731952 0.82 CYP3A4 (0.47) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL5164929 0.82 CYP3A4 (0.50) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL9235986 0.81 ALDH1A1 (0.40) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL9497372 0.80 CYP3A4 (0.59) CYP3A4L3MBTL1TSHRTDP1ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8536103-B2 Liquid extreme pressure additive THE LUBRIZOL CORPORATION 2013-09-17 US disclosed
US-20110028363-A1 Liquid Extreme Pressure Additive THE LUBRIZOL CORPORATION 2011-02-03 US disclosed
EP-2250242-A2 LIQUID EXTREME PRESSURE ADDITIVE The Lubrizol Corporation (US) 2010-11-17 EP disclosed
WO-2009111235-A2 LIQUID EXTREME PRESSURE ADDITIVE THE LUBRIZOL CORPORATION (US) 2009-09-11 WO disclosed
EP-0359522-B1 OIL-SOLUBLE PHOSPHORUS ANTIWEAR ADDITIVES FOR LUBRICANTS ETHYL PETROLEUM ADDITIVES, INC. (US) 1992-06-24 EP disclosed
EP-0359522-A1 Oil-soluble phosphorus antiwear additives for lubricants ETHYL PETROLEUM ADDITIVES, INC. (US) 1990-03-21 EP disclosed
US-4857214-A Oil-soluble phosphorus antiwear additives for lubricants Ethylk Petroleum Additives, Inc. (US) 1989-08-15 US disclosed