Sugi Predict

Sugi Predict / Compounds / SCHEMBL4944171

SCHEMBL4944171

SCHEMBL4944171

CCOC(=O)C(C(C)=O)C(C(C)=O)C(=O)OCC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.52
▸ LMNA P02545 2/20 0.52
▸ HSD17B10 Q99714 1/20 0.52
▸ TP53 P04637 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ GAA P10253 2/20 0.43
▸ ALOX15 P16050 1/20 0.43
▸ MGAM O43451 1/20 0.43
▸ SI P14410 1/20 0.43
▸ MGAM2 Q2M2H8 1/20 0.43
▸ SOAT1 P35610 1/20 0.43
▸ NPSR1 Q6W5P4 2/20 0.42
▸ HPGD P15428 2/20 0.42
▸ MAPT P10636 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ TRPA1 O75762 1/20 0.40
▸ GLO1 Q04760 1/20 0.39
▸ PKM P14618 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39

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
SCHEMBL27673788 0.91 ALDH1A1 (0.44) ALDH1A1LMNAHSD17B10TP53SMN1; SMN2
SCHEMBL1919905 0.87 ALDH1A1 (0.46) ALDH1A1LMNAHSD17B10TP53SMN1; SMN2
SCHEMBL10253096 0.87 ALDH1A1 (0.46) ALDH1A1LMNAHSD17B10TP53SMN1; SMN2
SCHEMBL14946230 0.85 ALDH1A1 (0.44) ALDH1A1LMNAHSD17B10TP53SMN1; SMN2
SCHEMBL28205003 0.85 ALDH1A1 (0.44) ALDH1A1LMNAHSD17B10TP53SMN1; SMN2
SCHEMBL4927145 0.85 ALDH1A1 (0.44) ALDH1A1LMNAHSD17B10TP53SMN1; SMN2
SCHEMBL6171372 0.85 ALDH1A1 (0.44) ALDH1A1LMNAHSD17B10TP53SMN1; SMN2
SCHEMBL18098648 0.85 ALDH1A1 (0.44) ALDH1A1LMNAHSD17B10TP53SMN1; SMN2
SCHEMBL9617476 0.85 ALDH1A1 (0.44) ALDH1A1LMNAHSD17B10TP53SMN1; SMN2
SCHEMBL2460611 0.85 ALDH1A1 (0.56) ALDH1A1LMNAHSD17B10GAAALOX15

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9821302-B2 Hydroprocessing catalyst, preparation method thereof and use of same TOTAL RAFFINAGE FRANCE (FR) 2017-11-21 — — US claimed
US-20160008799-A1 HYDROPROCESSING CATALYST, PREPARATION METHOD THEREOF AND USE OF SAME IFP Energies Nouvelles (FR) 2016-01-14 — — US claimed
CN-101107071-B Hydroprocessing catalyst, preparation method thereof and use of same TOTAL FRANCE 2011-05-18 — — CN claimed
US-20080194892-A1 Comprising a carrier based on a refractory oxide of a group VIII metal and of a group VIB metal as well as an organic compound comprising two carboxylic ester groups such as dimethyl succinate; desulfurization; denitrification; hydrogenation (dearomatizaation); petroleum distillates; purification TOTAL FRANCE (FR) 2008-08-14 — — US claimed
US-4200659-A Flavoring compositions containing dialkyl-α,β-diacyl succinates FRITZSCHE DODGE & OLCOTT INC. (US) 1980-04-29 — — US claimed
US-4140134-A FOR SMOKING MATERIALS FRITZSCHE DODGE & OLCOTT INC. (US) 1979-02-20 — — US claimed
US-9821302-B2 Hydroprocessing catalyst, preparation method thereof and use of same TOTAL RAFFINAGE FRANCE (FR) 2017-11-21 — — US disclosed
US-9683123-B2 Silver ink PESOLVE CO., LTD. (KR) 2017-06-20 — — US disclosed
US-20160168408-A1 SILVER INK PESOLVE CO., LTD. (KR) 2016-06-16 — — US disclosed
US-20160008799-A1 HYDROPROCESSING CATALYST, PREPARATION METHOD THEREOF AND USE OF SAME IFP Energies Nouvelles (FR) 2016-01-14 — — US disclosed
US-9212324-B2 Hydroprocessing catalyst, preparation method thereof and use of same TOTAL RAFFINAGE MARKETING (FR) 2015-12-15 — — US disclosed
CN-101486696-B Preparation of 2,5-dimethyl furan-3,4-dicarboxylic acid UNIV SOUTHWEST 2011-05-25 — — CN disclosed
CN-101107071-B Hydroprocessing catalyst, preparation method thereof and use of same TOTAL FRANCE 2011-05-18 — — CN disclosed
EP-0103486-B1 SMOKING COMPOSITIONS PHILIP MORRIS INCORPORATED (US) 1986-11-20 — — EP disclosed
US-4547568-A RELEASING FLAVOR UPON SMOKING PHILIP MORRIS INCORPORATED (US) 1985-10-15 — — US disclosed
US-4481956-A B-KETOCARBOXYLIC ACID ESTER OF CARBOHYDRATE OF ALGOLHOL PHILIP MORRIS INCORPORATED (US) 1984-11-13 — — US disclosed
EP-0103486-A1 Smoking compositions PHILIP MORRIS INCORPORATED (US) 1984-03-21 — — EP disclosed
US-4382972-A Flavoring compositions and flavored comestibles containing alkyl 2,3-dihydro-3(1'-hydroxyalkylidene)-2-oxo-5-alkylfuran-4-carboxylates FRITZSCHE DODGE & OLCOTT INC. (US) 1983-05-10 — — US disclosed
US-4200659-A Flavoring compositions containing dialkyl-α,β-diacyl succinates FRITZSCHE DODGE & OLCOTT INC. (US) 1980-04-29 — — US disclosed
US-4140134-A FOR SMOKING MATERIALS FRITZSCHE DODGE & OLCOTT INC. (US) 1979-02-20 — — 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-20160168408-A1 SILVER INK TP53, MKI67, NRAS ALDH1A1 23/4885LMNA 4641/4885HSD17B10 2342/4885
US-20080194892-A1 Comprising a carrier based on a refractory oxide of a group VIII metal and of a group VIB metal as well as an organic compound comprising two carboxylic ester groups such as dimethyl succinate; desulfurization; denitrification; hydrogenation (dearomatizaation); petroleum distillates; purification SDHB, SDHA, DECR1 ALDH1A1 659/4885LMNA 3135/4885HSD17B10 8/4885

“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.