SCHEMBL11599201

SCHEMBL11599201

O=C(O)C(CCCCCCCBr)=C(CCCCCCCBr)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FNTA P49354 4/20 0.50
FNTB P49356 4/20 0.50
THRB P10828 1/20 0.45
PGGT1B P53609 1/20 0.45
TSHR P16473 4/20 0.41
LMNA P02545 3/20 0.41
NFKB1 P19838 1/20 0.41
PMP22 Q01453 1/20 0.41
GPR84 Q9NQS5 4/20 0.35
FFAR1 O14842 2/20 0.35
FFAR4 Q5NUL3 2/20 0.35
TDP1 Q9NUW8 3/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
MAPT P10636 1/20 0.34
PPARG P37231 4/20 0.33
PPARD Q03181 4/20 0.33
PPARA Q07869 4/20 0.33
HDAC11 Q96DB2 3/20 0.33
ALDH1A1 P00352 2/20 0.33
SLC22A6 Q4U2R8 1/20 0.33

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
SCHEMBL11597751 1.00 FNTA (0.50) FNTAFNTBTHRBPGGT1BTSHR
SCHEMBL11597514 1.00 FNTA (0.50) FNTAFNTBTHRBPGGT1BTSHR
SCHEMBL11596484 1.00 FNTA (0.50) FNTAFNTBTHRBPGGT1BTSHR
SCHEMBL11597758 1.00 FNTA (0.50) FNTAFNTBTHRBPGGT1BTSHR
SCHEMBL11599194 1.00 FNTA (0.50) FNTAFNTBTHRBPGGT1BTSHR
SCHEMBL11596490 1.00 FNTA (0.50) FNTAFNTBTHRBPGGT1BTSHR
SCHEMBL11597522 1.00 FNTA (0.50) FNTAFNTBTHRBPGGT1BTSHR
SCHEMBL11598004 0.97 FNTA (0.46) FNTAFNTBTHRBPGGT1BTSHR
SCHEMBL11597996 0.97 FNTA (0.46) FNTAFNTBTHRBPGGT1BTSHR
SCHEMBL11597727 0.89 FNTA (0.43) FNTAFNTBTHRBPGGT1BTSHR

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
US-4107122-A Copolymer plasticizers comprising novel ω-bromoalkyl esters of acyclic unsaturated dicarboxylic acids MONSANTO COMPANY (US) 1978-08-15 US disclosed
US-4058658-A Copolymers of ω-bromoalkyl esters of acyclic unsaturated dicarboxylic acids MONSANTO COMPANY (US) 1977-11-15 US disclosed