SCHEMBL4842442

SCHEMBL4842442

CCCCCCCCCCCCCCCCC(CCCCCCCCCC)(CCCCCCCCCCCCCCC)[C](CCCCCCCCCCCCC)CCCCCCCCCCCCCC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 4/20 0.44
CES1 P23141 4/20 0.44
SMPD1 P17405 2/20 0.43
FDPS P14324 1/20 0.43
GPR84 Q9NQS5 7/20 0.42
PPARG P37231 7/20 0.42
PPARD Q03181 7/20 0.42
PPARA Q07869 7/20 0.42
HDAC11 Q96DB2 5/20 0.42
TSHR P16473 4/20 0.42
PTPN1 P18031 3/20 0.42
ALDH1A1 P00352 2/20 0.42
TLR2 O60603 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
FABP4 P15090 2/20 0.42
SLC22A6 Q4U2R8 1/20 0.42
SLC22A8 Q8TCC7 1/20 0.42
MEN1 O00255 1/20 0.42
ESR1 P03372 1/20 0.42
ALOX15 P16050 1/20 0.42

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
SCHEMBL7946938 1.00 CES2 (0.44) CES2CES1SMPD1FDPSGPR84
SCHEMBL20577197 1.00 CES2 (0.44) CES2CES1SMPD1FDPSGPR84
SCHEMBL1758483 1.00 CES2 (0.44) CES2CES1SMPD1FDPSGPR84
SCHEMBL11115222 1.00 CES2 (0.44) CES2CES1SMPD1FDPSGPR84
SCHEMBL9129289 1.00 CES2 (0.44) CES2CES1SMPD1FDPSGPR84
SCHEMBL1841613 1.00 CES2 (0.44) CES2CES1SMPD1FDPSGPR84
SCHEMBL8412528 0.98 CES2 (0.42) CES2CES1SMPD1FDPSGPR84
SCHEMBL2232002 0.98 CES2 (0.42) CES2CES1SMPD1FDPSGPR84
SCHEMBL17239408 0.93 SMPD1 (0.39) CES2CES1SMPD1FDPSGPR84
SCHEMBL9980601 0.93 FDPS (0.39) CES2CES1SMPD1FDPSGPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7452946-B2 copolymer with C3 to C10 alpha -olefin; provides a blow-molded product and an extrusion-molded product excellent in moldability, mechanical strength and outward appearance; produced in the presence of a solid catalyst MITSUI CHEMICALS, INC. (JP) 2008-11-18 US disclosed
US-20060199925-A1 Ethylene polymer MITSUI CHEMICALS, INC. (JP) 2006-09-07 US disclosed
EP-1632505-A1 ETHYLENE POLYMER Mitsui Chemicals, Inc. (JP) 2006-03-08 EP disclosed