SCHEMBL2222064

SCHEMBL2222064

CC(=O)CC(=O)COc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.59
MTNR1A P48039 4/20 0.51
MTNR1B P49286 4/20 0.51
KMT2A Q03164 3/20 0.51
MEN1 O00255 2/20 0.51
ALPL P05186 1/20 0.51
ALPI P09923 1/20 0.51
ALPG P10696 1/20 0.51
MAPT P10636 3/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
HPGD P15428 1/20 0.50
HTT P42858 1/20 0.50
ALDH1A1 P00352 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.49
GAA P10253 1/20 0.49
RAB9A P51151 1/20 0.48
POLB P06746 1/20 0.48
PKM P14618 1/20 0.48
GPR174 Q9BXC1 1/20 0.47

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
Calcium SCHEMBL30753803 0.98 ALOX15 (0.57) ALOX15MTNR1AMTNR1BKMT2AMEN1
Zinc Ion SCHEMBL30753804 0.98 ALOX15 (0.57) ALOX15MTNR1AMTNR1BKMT2AMEN1
SCHEMBL29158553 0.98 ALOX15 (0.57) ALOX15MTNR1AMTNR1BKMT2AMEN1
SCHEMBL29158554 0.98 ALOX15 (0.57) ALOX15MTNR1AMTNR1BKMT2AMEN1
SCHEMBL15396047 0.88 ALOX15 (0.68) ALOX15KMT2AMEN1ALPLALPI
SCHEMBL9824596 0.84 ALOX15 (0.69) ALOX15KMT2AMEN1ALPLALPI
SCHEMBL7746 0.84 ALOX15 (0.68) ALOX15MTNR1AMTNR1BKMT2AMEN1
SCHEMBL3898377 0.83 ALOX15 (0.74) ALOX15KMT2AMEN1ALPLALPI
SCHEMBL15777617 0.83 ALOX15 (0.57) ALOX15KMT2AMEN1ALPLALPI
SCHEMBL11577395 0.81 TDP1 (0.47) MAPTL3MBTL1SMN1; SMN2RAB9AGPR174

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117447319-A 1- (substituted benzene) oxy-2, 4-pentanedione compound or salt thereof and application thereof as PVC stabilizer 武汉埃迪鑫新材料科技有限公司 2024-01-26 CN claimed
US-20060142588-A1 Acetoacetylation of alcohols, thiols and amines in a microreactor CLARIANT PRODUKTE (DEUTSCHLAND) GMBH (DE) 2006-06-29 US claimed
CN-117447319-A 1- (substituted benzene) oxy-2, 4-pentanedione compound or salt thereof and application thereof as PVC stabilizer 武汉埃迪鑫新材料科技有限公司 2024-01-26 CN disclosed
EP-2216312-B1 PROCESS FOR PRODUCING ORGANIC COMPOUND M TECHNIQUE CO LTD (JP) 2019-05-01 EP disclosed
US-8592498-B2 Method for producing organic compound and organic compound obtained by the method M. TECHNIQUE CO., LTD. (JP) 2013-11-26 US disclosed
US-20110178199-A1 METHOD FOR PRODUCING ORGANIC COMPOUND AND ORGANIC COMPOUND OBTAINED BY THE METHOD M. TECHNIQUE CO., LTD. (JP) 2011-07-21 US disclosed
EP-2216312-A1 PROCESS FOR PRODUCING ORGANIC COMPOUND AND ORGANIC COMPOUND OBTAINED BY THE SAME M Technique Co., Ltd. (JP) 2010-08-11 EP disclosed
US-20060142588-A1 Acetoacetylation of alcohols, thiols and amines in a microreactor CLARIANT PRODUKTE (DEUTSCHLAND) GMBH (DE) 2006-06-29 US disclosed
EP-1590315-A1 ACETOACETYLATION OF ALCOHOLS, THIOLS AND AMINES IN A MICROREACTOR Clariant GmbH (DE) 2005-11-02 EP disclosed
WO-2004067492-A1 ACETOACETYLATION OF ALCOHOLS, THIOLS AND AMINES IN A MICROREACTOR CLARIANT GMBH (DE) 2004-08-12 WO 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-20110178199-A1 METHOD FOR PRODUCING ORGANIC COMPOUND AND ORGANIC COMPOUND OBTAINED BY THE METHOD OR10J3, PORCN, ABCG2 ALOX15 1920/4885MTNR1A 4862/4885MTNR1B 4739/4885
US-20060142588-A1 Acetoacetylation of alcohols, thiols and amines in a microreactor ADH1A, GRHPR, AKR1C2 ALOX15 2409/4885MTNR1A 652/4885MTNR1B 855/4885

“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.