Sugi Predict

Sugi Predict / Compounds / SCHEMBL2133759

SCHEMBL2133759

SCHEMBL2133759

CC(Cc1ccccc1C(C)(C)C)CN1C[C@@H](C)O[C@@H](C)C1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 3/20 0.61
▸ EBP Q15125 1/20 0.61
▸ ALDH1A1 P00352 4/20 0.56
▸ SMN1; SMN2 Q16637 3/20 0.56
▸ L3MBTL1 Q9Y468 2/20 0.56
▸ ADORA3 P0DMS8 1/20 0.54
▸ CHRM1 P11229 1/20 0.54
▸ DRD3 P35462 1/20 0.54
▸ KCNH2 Q12809 1/20 0.54
▸ KDM4E B2RXH2 3/20 0.45
▸ HTT P42858 1/20 0.45
▸ MAPK1 P28482 2/20 0.42
▸ CYP2A13 Q16696 1/20 0.40
▸ POLB P06746 2/20 0.38
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ THRB P10828 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ TSHR P16473 1/20 0.36

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
SCHEMBL2133766 1.00 SIGMAR1 (0.61) SIGMAR1EBPALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL11379151 0.89 SIGMAR1 (0.57) SIGMAR1EBPALDH1A1SMN1; SMN2L3MBTL1
Hydrochloric Acid SCHEMBL1934868 0.88 ADORA3 (0.62) SIGMAR1EBPALDH1A1SMN1; SMN2L3MBTL1
Hydrochloric Acid SCHEMBL1934864 0.88 ADORA3 (0.62) SIGMAR1EBPALDH1A1SMN1; SMN2L3MBTL1
Hydrochloric Acid SCHEMBL11387792 0.88 SIGMAR1 (0.56) SIGMAR1EBPALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL11389383 0.86 SIGMAR1 (0.54) SIGMAR1EBPALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL11383697 0.81 EBP (0.54) SIGMAR1EBPALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL10500566 0.79 EBP (0.51) SIGMAR1EBPALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL10576529 0.79 EBP (0.51) SIGMAR1EBPALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL7152529 0.78 CYP2D6 (0.43) ALDH1A1KDM4EPOLBMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8785662-B2 Anilide-based compounds for preserving wood and method of use thereof SDS BIOTECH K.K. (JP) 2014-07-22 — — US disclosed
US-20130059014-A1 PRESERVATIVE FOR PRESERVING WOOD AND METHOD FOR TREATING WOOD SDS BIOTECH K. K. (JP) 2013-03-07 — — US disclosed
US-20120100361-A1 ANTISEPTIC COMPOSITION FOR ENGINEERING WOOD PRODUCTION, AND ENGINEERING WOOD SDS BIOTECH K.K. (JP) 2012-04-26 — — US disclosed
US-20110256238-A1 WOOD PRESERVATIVE AND WOOD PROCESSING METHOD SDS BIOTECH K.K. (JP) 2011-10-20 — — US disclosed
EP-1051289-B1 PROTECTIVE AGENTS FOR WOOD LONZA AG (CH) 2005-10-05 — — EP disclosed
EP-1097031-B1 AGENTS AND METHOD FOR THE PROTECTIVE TREATMENT OF WOOD LONZA AG (CH) 2003-11-05 — — EP disclosed
US-6464764-B1 Protective agents for wood LONZA AG (CH) 2002-10-15 — — US disclosed
US-6362370-B1 QUATERNARY AMMONIUM SALTS WITH CARBOXYLIC ACIDS CONTAINING AT LEAST ONE HYDROXYL, AMINO OR SULPHONIC ACID GROUP; BIOCIDE; PENETRATES EASILY LONZA AG (CH) 2002-03-26 — — US disclosed
EP-0906177-B1 WOOD PRESERVATIVES LONZA AG (CH) 2002-03-20 — — EP disclosed
US-6348089-B1 PRESSURE TREATING WITH STABLE EMULSION OF COAL-TAR OIL, BIOCIDALLY ACTIVE QUATERNARY AMMONIUM COMPOUND AND WATER, TOGETHER WITH A GLYCOL POLAR SOLVENT; GOOD PENETRABILITY, REDUCED ODOR, REDUCED ?BLEEDING? AT HOT TEMPERATURES, LESS LONZA AG (CH) 2002-02-19 — — US disclosed
EP-1051289-A1 PROTECTIVE AGENTS FOR WOOD Lonza AG (CH) 2000-11-15 — — EP disclosed
WO-1999039886-A1 PROTECTIVE AGENTS FOR WOOD LONZA AG (CH) 1999-08-12 — — WO disclosed
EP-0906177-A1 WOOD PRESERVATIVES LONZA A.G. (CH) 1999-04-07 — — EP disclosed
EP-0863709-A1 WATER-BASED SOLVANT-FREE AND EMULSIFIER-FREE MICROBICIDAL COMBINATION OF ACTIVE SUBSTANCES BAYER AG (DE) 1998-09-16 — — EP disclosed
WO-1997045236-A1 WOOD PRESERVATIVES LONZA AG (CH) 1997-12-04 — — WO disclosed
EP-0802027-A1 Process for the antifouling protection of glued boards and boards stacked on pile Ostermann & Scheiwe GmbH & Co (DE) 1997-10-22 — — EP disclosed
WO-1997018713-A1 WATER-BASED SOLVANT-FREE AND EMULSIFIER-FREE MICROBICIDAL COMBINATION OF ACTIVE SUBSTANCES BAYER AKTIENGESELLSCHAFT (DE) 1997-05-29 — — WO disclosed
US-5095021-A PHENYLALKYLAMINES AND FUNGICIDES CONTAINING THESE BASF AKTIENGESELLSCHAFT (DE) 1992-03-10 — — US disclosed
US-4822889-A Triazolyl alcohols, their preparation and their use as fungicides BASF AKTIENGESELLSCHAFT (DE) 1989-04-18 — — 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 (2 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-20130059014-A1 PRESERVATIVE FOR PRESERVING WOOD AND METHOD FOR TREATING WOOD ALKBH5, DCXR, AKR7A2 SIGMAR1 4698/4885EBP 920/4885ALDH1A1 88/4885
US-20110256238-A1 WOOD PRESERVATIVE AND WOOD PROCESSING METHOD CYP51A1, HPD, AKR7A2 SIGMAR1 4746/4885EBP 568/4885ALDH1A1 162/4885

“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.