SCHEMBL393910

SCHEMBL393910

C=CCCCCCCC(=CC)CCCCC=C

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.54
ABCC4 O15439 1/20 0.54
ALDH1A1 P00352 4/20 0.52
LMNA P02545 2/20 0.52
TSHR P16473 3/20 0.50
LPAR3 Q9UBY5 2/20 0.38
LPAR2 Q9HBW0 1/20 0.38
CYP3A4 P08684 3/20 0.37
USP2 O75604 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
RECQL P46063 1/20 0.37
TRPA1 O75762 1/20 0.35
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
HPGD P15428 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
SCHEMBL14481454 1.00 MAPT (0.54) MAPTABCC4ALDH1A1LMNATSHR
SCHEMBL395384 0.95 MAPT (0.50) MAPTABCC4ALDH1A1LMNATSHR
SCHEMBL393714 0.93 MAPT (0.46) MAPTABCC4ALDH1A1LMNATSHR
SCHEMBL29047256 0.91 TSHR (0.60) MAPTABCC4ALDH1A1LMNATSHR
SCHEMBL2066529 0.89 TSHR (0.50) MAPTABCC4ALDH1A1LMNATSHR
SCHEMBL3447108 0.89 TSHR (0.50) MAPTABCC4ALDH1A1LMNATSHR
SCHEMBL846699 0.89 TSHR (0.50) MAPTABCC4ALDH1A1LMNATSHR
SCHEMBL3447109 0.89 TSHR (0.50) MAPTABCC4ALDH1A1LMNATSHR
SCHEMBL2066527 0.89 TSHR (0.50) MAPTABCC4ALDH1A1LMNATSHR
SCHEMBL846700 0.89 TSHR (0.50) MAPTABCC4ALDH1A1LMNATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0940448-B1 Reinforced composition DEGUSSA (DE) 2005-03-09 EP claimed
US-20150322314-A1 Moisture-Curing Polyurethane Composition Comprising Sustainably Produced Raw Materials HENKEL AG & CO. KGAA (DE) 2015-11-12 US disclosed
US-8101681-B2 Prepolymer mixture containing silyl groups and use thereof HENKEL AG & CO. KGAA (DE) 2012-01-24 US disclosed
US-20090306283-A1 PREPOLYMER MIXTURE CONTAINING SILYL GROUPS AND USE THEREOF HENKEL AG & CO. KGAA (DE) 2009-12-10 US disclosed