SCHEMBL1230554

SCHEMBL1230554

C=CCCCCC(C)([O])COC

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
LMNA P02545 1/20 0.39
TSHR P16473 2/20 0.35
LPAR2 Q9HBW0 1/20 0.32
LPAR3 Q9UBY5 1/20 0.32
ABCC4 O15439 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL1229634 0.98 ALDH1A1 (0.42) ALDH1A1LMNATSHRLPAR2LPAR3
SCHEMBL2521791 0.76 TSHR (0.48) ALDH1A1LMNATSHRLPAR2LPAR3
SCHEMBL4904636 0.74 ALDH1A1 (0.38) ALDH1A1LMNATSHRABCC4MAPT
SCHEMBL2521792 0.73 TSHR (0.48) ALDH1A1LMNATSHRLPAR2LPAR3
SCHEMBL1229325 0.73
SCHEMBL17520242 0.69 TSHR (0.44) ALDH1A1LMNATSHRLPAR2LPAR3
SCHEMBL17520209 0.69 TSHR (0.44) ALDH1A1LMNATSHRLPAR2LPAR3
SCHEMBL2010651 0.69 TSHR (0.48) ALDH1A1LMNATSHRLPAR2LPAR3
SCHEMBL9211254 0.69 TSHR (0.48) ALDH1A1LMNATSHRLPAR2LPAR3
SCHEMBL9211215 0.69 TSHR (0.48) ALDH1A1LMNATSHRLPAR2LPAR3

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-2462174-A1 BINDING AGENTS BASED ON HIGHLY BRANCHED POLYOLEFINS COMPRISING SILANE GROUPS Wacker Chemie AG (DE) 2012-06-13 EP disclosed
WO-2011015547-A1 BINDING AGENTS BASED ON HIGHLY BRANCHED POLYOLEFINS COMPRISING SILANE GROUPS WACKER CHEMIE AG (DE) 2011-02-10 WO disclosed