Sugi Predict

Sugi Predict / Compounds / SCHEMBL751516

SCHEMBL751516

SCHEMBL751516

O=C(CC(=O)c1ccc(Br)cc1)c1ccccc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 3/20 0.74
▸ MEN1 O00255 3/20 0.74
▸ KMT2A Q03164 3/20 0.74
▸ MAPT P10636 3/20 0.74
▸ CYP3A4 P08684 2/20 0.74
▸ KDM4E B2RXH2 2/20 0.74
▸ MAPK1 P28482 2/20 0.74
▸ ALOX15 P16050 1/20 0.74
▸ CES1 P23141 1/20 0.74
▸ SMN1; SMN2 Q16637 1/20 0.74
▸ TDP1 Q9NUW8 1/20 0.74
▸ NPC1 O15118 2/20 0.64
▸ RAB9A P51151 2/20 0.64
▸ HAO1 Q9UJM8 1/20 0.61
▸ GSK3B P49841 5/20 0.59
▸ ALDH1A1 P00352 4/20 0.59
▸ PLOD2 O00469 2/20 0.59
▸ HIF1A Q16665 2/20 0.59
▸ PLOD3 O60568 1/20 0.59
▸ CYP1A2 P05177 1/20 0.59

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
SCHEMBL28972855 0.94 KMT2A (0.65) HPGDMEN1KMT2AMAPTCYP3A4
SCHEMBL1305020 0.91 GSK3B (0.70) HPGDMEN1KMT2AMAPTCYP3A4
SCHEMBL2005451 0.89 MEN1 (0.94) HPGDMEN1KMT2AMAPTCYP3A4
Dibenzoylmethane SCHEMBL39582 0.86 MEN1 (1.00) HPGDMEN1KMT2AMAPTCYP3A4
Dibenzoylmethane SCHEMBL10356288 0.86 MEN1 (1.00) HPGDMEN1KMT2AMAPTCYP3A4
Dibenzoylmethane SCHEMBL1704711 0.86 MEN1 (1.00) HPGDMEN1KMT2AMAPTCYP3A4
SCHEMBL2635792 0.84 HAO1 (0.63) HPGDMEN1KMT2AMAPTCYP3A4
SCHEMBL734402 0.84 CES1 (0.52) HPGDMEN1KMT2AMAPTCYP3A4
Dibenzoylmethane SCHEMBL1628627 0.84 MEN1 (0.94) HPGDMEN1KMT2AMAPTCYP3A4
Dibenzoylmethane SCHEMBL6598370 0.84 MEN1 (0.94) HPGDMEN1KMT2AMAPTCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105523874-A Preparation method of 2,2-dihalo-1,3-dicarbonyl derivatives ZHANGJIAGANG INST IND TECHNOLOGIES SOOCHOW UNIV 2016-04-27 — — CN claimed
CN-105503635-A Preparation method for 2-amidoformyl-1,3-dicarbonyl derivative UNIV SOOCHOW 2016-04-20 — — CN claimed
CN-105503945-A Method for preparing 2-phosphonic acid ester base-1, 3-dicarbonyl derivative UNIV SOOCHOW 2016-04-20 — — CN claimed
CN-105348060-A Preparation method of 1,2-diketone derivative CHINASUN SPECIALTY PRODUCTS CO LTD 2016-02-24 — — CN claimed
CN-105254483-A Method for preparing 2-methyl-1,3-dicarbonyl derivative UNIV SOOCHOW 2016-01-20 — — CN claimed
US-7067702-B2 Process for preparing vinyl substituted beta-diketones THE JOHNS HOPKINS UNIVERSITY (US) 2006-06-27 — — US claimed
US-20060069288-A1 Process for preparing vinyl substituted beta-diketones THE JOHNS HOPKINS UNIVERSITY 2006-03-30 — — US claimed
CN-110746278-B Nonmetal-catalyzed method for preparing 1, 3-diketone compound based on alkynone 四川轻化工大学 2022-07-12 — — CN disclosed
EP-1245659-B2 Polymeric light emitting substance and polymer light emitting device using the same SUMITOMO CHEMICAL CO (JP) 2020-03-11 — — EP disclosed
CN-110746278-A Nonmetal-catalyzed method for preparing 1, 3-diketone compound based on alkynone 四川轻化工大学 2020-02-04 — — CN disclosed
US-10141513-B2 Polymeric light emitting substance and polymer light emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-11-27 — — US disclosed
CN-105348060-B A kind of preparation method of 1,2 derovatives 江苏强盛功能化学股份有限公司 2018-03-27 — — CN disclosed
CN-105461496-B A kind of preparation method of the Dicarbonyl derivatives of 2 halo 1,3 江苏强盛功能化学股份有限公司 2018-01-30 — — CN disclosed
EP-1745055-A1 POROUS HYBRID ORGANIC-INORGANIC MATERIALS FOR THE DETECTION OF HALOGENS COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) 2007-01-24 — — EP disclosed
US-7067702-B2 Process for preparing vinyl substituted beta-diketones THE JOHNS HOPKINS UNIVERSITY (US) 2006-06-27 — — US disclosed
US-20060069288-A1 Process for preparing vinyl substituted beta-diketones THE JOHNS HOPKINS UNIVERSITY 2006-03-30 — — US disclosed
WO-2005100371-A1 POROUS HYBRID ORGANIC-INORGANIC MATERIALS FOR THE DETECTION OF HALOGENS COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) 2005-10-27 — — WO disclosed
US-20020193532-A1 Comprises polystyrene and organometallic polymer; luminescence; for use in spin coating and ink jet printing SUMITOMO CHEMICAL COMPANY, LIMITED 2002-12-19 — — US disclosed
EP-1245659-A1 Polymeric light emitting substance and polymer light emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-10-02 — — EP disclosed
US-3932182-A An organic photoconductive composition comprising an organic photoconductive compound and a sensitizing compound having an active methylene group MITSUBISHI PAPER MILLS, LTD. (JA) 1976-01-13 — — 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-20060069288-A1 Process for preparing vinyl substituted beta-diketones VRK1, VRK2, DEK HPGD 1787/4885MEN1 2957/4885KMT2A 1338/4885

“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.