SCHEMBL8058797

SCHEMBL8058797

C=CCC(CCCC)OC(=O)O

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.39
ACHE P22303 1/20 0.38
BACE1 P56817 1/20 0.38
CTSK P43235 3/20 0.37
MAPK1 P28482 2/20 0.37
CA2 P00918 2/20 0.37
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.35
FAAH O00519 1/20 0.35
PRKCA P17252 1/20 0.35
PRKCD Q05655 1/20 0.35
LMNA P02545 3/20 0.34
CA1 P00915 1/20 0.34
ALDH1A1 P00352 1/20 0.34
CYP3A4 P08684 1/20 0.34
ATM Q13315 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CYP1A2 P05177 1/20 0.33
FFAR4 Q5NUL3 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
SCHEMBL31216727 0.93 TSHR (0.44) TSHRMAPK1MAPTFAAHLMNA
SCHEMBL7738388 0.89 CTSK (0.36) TSHRCTSKMAPK1MAPTFAAH
SCHEMBL3217709 0.86 PRKCA (0.43) TSHRCTSKMAPK1MAPTHPGD
SCHEMBL7593898 0.86 TSHR (0.39) TSHRACHEBACE1CTSKMAPK1
SCHEMBL561185 0.84 CTSK (0.40) TSHRACHEBACE1CTSKMAPK1
SCHEMBL8667788 0.84 TSHR (0.49) TSHRACHEBACE1CTSKMAPK1
SCHEMBL5437471 0.84 TSHR (0.38) TSHRACHEBACE1CTSKMAPK1
SCHEMBL5132770 0.83 MAPT (0.45) TSHRCTSKMAPK1MAPTHPGD
SCHEMBL1837070 0.82 CA2 (0.46) ACHEBACE1CTSKMAPK1CA2
SCHEMBL15942359 0.81 TSHR (0.40) TSHRACHEBACE1CTSKCA2

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
JP-5148189-A None JP disclosed
US-20170283680-A1 EMULSIFIERS FOR INVERT EMULSION WELLBORE FLUIDS AND METHODS OF USE THEREOF M-I L.L.C. 2017-10-05 US disclosed
WO-2017173010-A1 EMULSIFIERS FOR INVERT EMULSION WELLBORE FLUIDS AND METHODS OF USE THEREOF M-I L.L.C. (US) 2017-10-05 WO disclosed
EP-0979535-A1 METHOD OF PREPARING ELECTROCHEMICAL CELLS VALENCE TECHNOLOGY, INC. (US) 2000-02-16 EP disclosed
US-5964903-A Method of preparing electrochemical cells VALENCE TECHNOLOGY, INC. (US) 1999-10-12 US disclosed
WO-1998048469-A1 METHOD OF PREPARING ELECTROCHEMICAL CELLS VALENCE TECHNOLOGY, INC. (US) 1998-10-29 WO disclosed
JP-H05148189-A PRODUCTION OF AROMATIC CARBONIC ACID ESTERS UBE IND LTD 1993-06-15 JP disclosed
US-4609501-A CATALYZED TRANSESTERIFICATION GENERAL ELECTRIC COMPANY (US) 1986-09-02 US disclosed
US-4554110-A Process for the preparation of aromatic carbonates GENERAL ELECTRIC COMPANY (US) 1985-11-19 US disclosed
US-4552704-A PHENOL, ALIPHATIC CARBONATE, ORGANOTIN OR -TITANIUM CATALYST GENERAL ELECTRIC COMPANY (US) 1985-11-12 US disclosed