SCHEMBL825697

SCHEMBL825697

C=C(CC(CCC)CCCCC)OC(=C)CC(CCC)CCCCC

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.43
GPR84 Q9NQS5 7/20 0.35
FFAR1 O14842 1/20 0.35
ALDH1A1 P00352 1/20 0.34
SMPD1 P17405 3/20 0.32
FDPS P14324 1/20 0.32
OPRM1 P35372 1/20 0.32
TLR4 O00206 1/20 0.32
TSHR P16473 1/20 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
SCHEMBL75661 0.82 ALDH1A1 (0.50) LMNAALDH1A1TSHR
SCHEMBL27885691 0.74 ZDHHC7 (0.42) LMNAGPR84FFAR1TLR4TSHR
SCHEMBL28049395 0.74 LMNA (0.50) LMNAGPR84ALDH1A1SMPD1FDPS
SCHEMBL6861932 0.73 LMNA (0.45) LMNAGPR84FFAR1FDPS
SCHEMBL102584 0.73 LMNA (0.48) LMNAGPR84ALDH1A1FDPSOPRM1
SCHEMBL166221 0.73 GPR84 (0.43) LMNAGPR84FFAR1
SCHEMBL8679451 0.72 LMNA (0.57) LMNAGPR84ALDH1A1FDPSOPRM1
SCHEMBL4072853 0.72 LMNA (0.57) LMNAGPR84ALDH1A1FDPSOPRM1
SCHEMBL6853532 0.72 LMNA (0.48) LMNAGPR84FFAR1FDPS
SCHEMBL198808 0.72 LMNA (0.52) LMNAGPR84FFAR1ALDH1A1FDPS

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
EP-2585498-B1 QUATERNIZED COPOLYMER BASF SE (DE) 2018-05-30 EP disclosed
EP-2585498-A1 QUATERNIZED COPOLYMER BASF SE (DE) 2013-05-01 EP disclosed
WO-2011161149-A1 QUATERNIZED COPOLYMER BASF SE (DE) 2011-12-29 WO disclosed