SCHEMBL4164973

SCHEMBL4164973

CCCCC(CC)OB(OC(CC)CCCC)OC(CC)CCCC

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.36
TDP1 Q9NUW8 2/20 0.36
PRKCA P17252 1/20 0.35
PRKCD Q05655 1/20 0.35
DNM1 Q05193 2/20 0.35
TSHR P16473 4/20 0.34
CYP3A4 P08684 4/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CA2 P00918 5/20 0.34
CA1 P00915 3/20 0.34
CTSK P43235 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
MAPK1 P28482 1/20 0.33
ATM Q13315 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
SCHEMBL4730323 0.93 OPRM1 (0.37) DNM1TSHR
SCHEMBL10672112 0.81 ALDH1A1 (0.38) ALDH1A1TDP1PRKCAPRKCDDNM1
SCHEMBL4169871 0.78
SCHEMBL887651 0.76 ALDH1A1 (0.40) ALDH1A1TDP1PRKCAPRKCDDNM1
SCHEMBL10533388 0.75 LMNA (0.37) PRKCAPRKCDCA1
Magnesium SCHEMBL10632211 0.74 ALDH1A1 (0.39) ALDH1A1TDP1PRKCAPRKCDDNM1
SCHEMBL10642096 0.74
SCHEMBL19060744 0.72 ALDH1A1 (0.37) ALDH1A1TDP1PRKCAPRKCDDNM1
SCHEMBL10642093 0.72
SCHEMBL14565671 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090110842-A1 Boron-based wood preservatives and treatment of wood with boron-based preservatives THE UNIVERSITY OF MELBOUME (AU) 2009-04-30 US disclosed
US-20090069271-A1 WOOD TREATMENT STANIMIROFF IVAN LAURENCE 2009-03-12 US disclosed
EP-1945424-A1 WOOD TREATMENT Stanimiroff, Ivan Laurence (NZ) 2008-07-23 EP disclosed
WO-2007055601-A1 WOOD TREATMENT STANIMIROFF IVAN LAURENCE (NZ) 2007-05-18 WO disclosed
US-20050013939-A1 Boron-based wood preservatives and treatment of wood with boron-based preservatives THE UNIVERSITY OF MELBOURNE (AU) 2005-01-20 US disclosed
WO-2002102560-A1 BORON-BASED WOOD PRESERVATIVES AND TREATMENT OF WOOD WITH BORON-BASED PRESERVATIVES THE UNIVERSITY OF MELBOURNE (AU) 2002-12-27 WO disclosed
US-4281173-A Preparation of unsaturated diesters by catalytic oxidative carbonylation of diolefins ATLANTIC RICHFIELD COMPANY (US) 1981-07-28 US disclosed
US-4195184-A Preparation of unsaturated monoesters by catalytic oxidative carbonylation of diolefins ATLANTIC RICHFIELD COMPANY (US) 1980-03-25 US disclosed
US-4189599-A Preparation of dimethyl adipate by the hydrogenation of dimethyl hex-3-endioate ATLANTIC RICHFIELD COMPANY (US) 1980-02-19 US disclosed
US-4171450-A Preparation of unsaturated diesters by catalytic oxidative carbonylation of diolefins ATLANTIC RICHFIELD COMPANY (US) 1979-10-16 US disclosed
US-4041068-A AS CATALYST A PALLADIUM, PLATINUM OR RHODIUM SALT WITH AN AMINE AND AN ALCOHOL ATLANTIC RICHFIELD COMPANY (US) 1977-08-09 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050013939-A1 Boron-based wood preservatives and treatment of wood with boron-based preservatives BTD, ADH1C, BROX ALDH1A1 269/4885TDP1 1909/4885PRKCA 4498/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.