SCHEMBL3416382

SCHEMBL3416382

C=CC(=O)OCCCCC=CF

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.64
ALDH1A1 P00352 4/20 0.64
CYP3A4 P08684 2/20 0.64
TP53 P04637 3/20 0.53
HIF1A Q16665 3/20 0.53
HSD17B10 Q99714 1/20 0.53
HPGD P15428 1/20 0.53
THRB P10828 2/20 0.41
MAPK1 P28482 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ATM Q13315 1/20 0.34
HCAR2 Q8TDS4 2/20 0.33
FAAH O00519 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
SCHEMBL4566185 0.94 TSHR (0.61) TSHRALDH1A1CYP3A4TP53HIF1A
SCHEMBL13945620 0.86 TSHR (0.79) TSHRALDH1A1CYP3A4TP53HIF1A
SCHEMBL6530911 0.86 TSHR (0.59) TSHRALDH1A1CYP3A4TP53HIF1A
SCHEMBL244114 0.82 TSHR (0.95) TSHRALDH1A1CYP3A4TP53HIF1A
SCHEMBL2109543 0.81 TSHR (0.64) TSHRALDH1A1CYP3A4TP53HIF1A
SCHEMBL28584786 0.81 TSHR (0.64) TSHRALDH1A1CYP3A4TP53HIF1A
SCHEMBL8729462 0.81 TSHR (0.64) TSHRALDH1A1CYP3A4TP53HIF1A
SCHEMBL85963 0.80 TSHR (0.75) TSHRALDH1A1CYP3A4TP53HIF1A
SCHEMBL16180094 0.80 TSHR (0.72) TSHRALDH1A1CYP3A4TP53HIF1A
SCHEMBL16180095 0.80 TSHR (0.72) TSHRALDH1A1CYP3A4TP53HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1964862-B1 Composition and method for preparing linear copolymers of polar and non-polar olefins free of free radical initiated polymer ROHM & HAAS (US) 2010-12-22 EP disclosed
US-7524912-B2 Preparation of linear ethylene-acrylate copolymers with palladium catalysts and free radical scavengers ROHM AND HAAS COMPANY (US) 2009-04-28 US disclosed
EP-1964862-A1 Composition and method for preparing linear copolymers of polar and non-polar olefins absent free radical addition polymer Rohm and Haas Company (US) 2008-09-03 EP disclosed
EP-1964859-A1 A porous linear polymer composition Rohm and Haas Company (US) 2008-09-03 EP disclosed
US-20080207789-A1 Porous linear polymer composition ACHOLLA FRANCIS V 2008-08-28 US disclosed
US-20080207856-A1 Composition and method for preparing copolymers of polar and non-polar olefins substantially free of free radical initiated polymer ROHM AND HAAS COMPANY 2008-08-28 US disclosed