SCHEMBL340013

SCHEMBL340013

CC(C)(C)c1ccc(-c2ccc(C(C)(C)C)cc2O)c(O)c1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.73
ALOX15 P16050 2/20 0.73
HPGD P15428 2/20 0.73
HSD17B10 Q99714 2/20 0.73
TDP1 Q9NUW8 1/20 0.73
MAPT P10636 3/20 0.58
MEN1 O00255 1/20 0.58
GAA P10253 1/20 0.58
PKM P14618 1/20 0.58
RECQL P46063 1/20 0.58
KMT2A Q03164 1/20 0.58
LMNA P02545 1/20 0.52
TYR P14679 1/20 0.52
CYP2D6 P10635 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
HDAC4 P56524 1/20 0.48
HDAC2 Q92769 1/20 0.48
HDAC8 Q9BY41 1/20 0.48
NPC1 O15118 1/20 0.48
PLA2G1B P04054 1/20 0.48

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
SCHEMBL31411213 1.00 ALDH1A1 (0.73) ALDH1A1ALOX15HPGDHSD17B10TDP1
SCHEMBL7943115 0.89 ALDH1A1 (0.59) ALDH1A1ALOX15HPGDHSD17B10TDP1
SCHEMBL31315462 0.88 ALDH1A1 (0.64) ALDH1A1ALOX15HPGDHSD17B10TDP1
SCHEMBL29358687 0.84 ALDH1A1 (1.00) ALDH1A1ALOX15HPGDHSD17B10TDP1
SCHEMBL50705 0.84 ALDH1A1 (1.00) ALDH1A1ALOX15HPGDHSD17B10TDP1
SCHEMBL30382738 0.83 ALDH1A1 (0.57) ALDH1A1ALOX15HPGDHSD17B10TDP1
SCHEMBL13454410 0.83 ALDH1A1 (0.57) ALDH1A1ALOX15HPGDHSD17B10TDP1
SCHEMBL5681640 0.82 ALDH1A1 (0.52) ALDH1A1ALOX15HPGDHSD17B10TDP1
SCHEMBL18826219 0.82 ALDH1A1 (0.52) ALDH1A1ALOX15HPGDHSD17B10TDP1
SCHEMBL12078076 0.82 ALDH1A1 (0.95) ALDH1A1ALOX15HPGDHSD17B10TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106349024-A Synthesis method and application of hindered phenol antioxidant 彤程化学(中国)有限公司 2017-01-25 CN disclosed
EP-2271651-B1 ISOTHERMAL PROCESS FOR PHOSPHOROMONOCHLORIDITE SYNTHESIS DOW GLOBAL TECHNOLOGIES LLC (US) 2014-01-01 EP disclosed
EP-2346887-B1 SLURRY PROCESS FOR SYNTHESIS OF BISPHOSPHITES DOW TECHNOLOGY INVESTMENTS LLC (US) 2013-12-25 EP disclosed
US-8546600-B2 Slurry process for synthesis of bisphosphites and situ use thereof for producing bisphosphite DOW TECHNOLOGY INVESTMENTS LLC 2013-10-01 US disclosed
EP-2257560-B1 SLURRY PROCESS FOR PHOSPHOROMONOCHLORIDITE SYNTHESIS UNION CARBIDE CHEM PLASTIC (US) 2013-07-17 EP disclosed
US-8471066-B2 Slurry process for phosphoromonochloridite synthesis UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY LLC 2013-06-25 US disclosed
US-8097749-B2 Isothermal process for phosphoromonochloridite synthesis Union Carbide Chemical and Plastics Technology Technology 2012-01-17 US disclosed
US-20110196166-A1 SLURRY PROCESS FOR SYNTHESIS OF BISPHOSPHITES AND SITU USE THEREOF FOR PRODUCING BISPHOSPHITE DOW TECHNOLOGY INVESTMENTS LLC 2011-08-11 US disclosed
US-20110021840-A1 SLURRY PROCESS FOR PHOSPHOROMONOCHLORIDITE SYTHESIS UNION CARBIDE CORPORATION 2011-01-27 US disclosed
EP-2271651-A1 ISOTHERMAL PROCESS FOR PHOSPHOROMONOCHLORIDITE SYNTHESIS Dow Global Technologies Inc. (US) 2011-01-12 EP disclosed
EP-2257560-A1 SLURRY PROCESS FOR PHOSPHOROMONOCHLORIDITE SYNTHESIS Union Carbide Chemicals & Plastics Technology Llc (Formerly Union Carbide Chemicals & Plastics Technology Corporation) (US) 2010-12-08 EP disclosed
WO-2009120210-A1 ISOTHERMAL PROCESS FOR PHOSPHOROMONOCHLORIDITE SYNTHESIS DOW GLOBAL TECHNOLOGIES INC. (US) 2009-10-01 WO disclosed
US-20090247790-A1 ISOTHERMAL PROCESS FOR PHOSPHOROMONOCHLORIDITE SYNTHESIS UNION CARBIDE CORPORATION 2009-10-01 US disclosed
WO-2009120529-A1 SLURRY PROCESS FOR PHOSPHOROMONOCHLORIDITE SYNTHESIS UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY LLC (FORMERLY UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION) (US) 2009-10-01 WO disclosed
EP-0590613-B1 Improved hydroformylation process UNION CARBIDE CHEM PLASTIC (US) 1997-01-08 EP disclosed
EP-0590613-A2 Improved hydroformylation process UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1994-04-06 EP 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 (3 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-20090247790-A1 ISOTHERMAL PROCESS FOR PHOSPHOROMONOCHLORIDITE SYNTHESIS PIM3, PLCB3, PLCD1 ALDH1A1 4149/4885ALOX15 2223/4885HPGD 3289/4885
US-20110196166-A1 SLURRY PROCESS FOR SYNTHESIS OF BISPHOSPHITES AND SITU USE THEREOF FOR PRODUCING BISPHOSPHITE SOST, PLCB3, PPIP5K2 ALDH1A1 4653/4885ALOX15 2202/4885HPGD 3513/4885
US-20110021840-A1 SLURRY PROCESS FOR PHOSPHOROMONOCHLORIDITE SYTHESIS PSPH, SPIN3, SYNGR2 ALDH1A1 4865/4885ALOX15 3604/4885HPGD 3090/4885

“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.