SCHEMBL1700716

SCHEMBL1700716

CC(C)(C)CC(C)(C)C(C(=O)O)=C(C(=O)O)C(C)(C)CC(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.32
HMGCR P04035 1/20 0.32
CHRM1 P11229 1/20 0.32
TBXA2R P21731 1/20 0.32
ADRA1A P35348 1/20 0.32
TSHR P16473 2/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31
HIF1A Q16665 1/20 0.31
TET2 Q6N021 1/20 0.30

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
SCHEMBL1700714 1.00 POLB (0.32) POLBHMGCRCHRM1TBXA2RADRA1A
SCHEMBL85014 0.77 TSHR (0.42) POLBHMGCRCHRM1TBXA2RADRA1A
SCHEMBL7195884 0.74 RIPK1 (0.36) POLBHMGCRCHRM1TBXA2RADRA1A
SCHEMBL7195881 0.74 RIPK1 (0.36) POLBHMGCRCHRM1TBXA2RADRA1A
SCHEMBL9344788 0.74
SCHEMBL3775748 0.74 TET2 (0.37) POLBTET2
Ethylene SCHEMBL28118800 0.72 TSHR (0.38) POLBHMGCRCHRM1TBXA2RADRA1A
Bicarbonate SCHEMBL26105671 0.72 TSHR (0.41) POLBHMGCRCHRM1TBXA2RADRA1A
SCHEMBL431250 0.71 POLB (0.30) POLB
SCHEMBL673097 0.71 GAA (0.35) POLBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3523382-B1 METHOD FOR PRODUCING AQUEOUS DISPERSIONS BASF SE (DE) 2020-11-18 EP disclosed
EP-3523382-A1 METHOD FOR PRODUCING AQUEOUS DISPERSIONS BASF SE (DE) 2019-08-14 EP disclosed
WO-2018065571-A1 METHOD FOR PRODUCING AQUEOUS DISPERSIONS BASF SE (DE) 2018-04-12 WO disclosed
WO-2015150508-A1 AQUEOUS POLYMER COMPOSITIONS BASF SE (DE) 2015-10-08 WO disclosed
EP-2582761-B1 AQUEOUS BINDING AGENT COMPOSITIONS BASF SE (DE) 2015-03-18 EP disclosed
EP-2379603-B1 BINDER COMPOSITIONS COMPRISING BORIC ACID OR BORIC ACID SALT BASF SE (DE) 2013-05-01 EP disclosed
EP-2582761-A1 AQUEOUS BINDING AGENT COMPOSITIONS BASF SE (DE) 2013-04-24 EP disclosed
WO-2011157792-A1 AQUEOUS BINDING AGENT COMPOSITIONS BASF SE (DE) 2011-12-22 WO disclosed
EP-2379603-A1 BINDER COMPOSITIONS COMPRISING BORIC ACID OR BORIC ACID SALT BASF SE (DE) 2011-10-26 EP disclosed
WO-2010072697-A1 BINDER COMPOSITIONS COMPRISING BORIC ACID OR BORIC ACID SALT BASF SE (DE) 2010-07-01 WO disclosed