SCHEMBL780426

SCHEMBL780426

CC(C)CCOC(=O)C1CCCCC1C(=O)OCCC(C)C

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.46
CYP3A4 P08684 1/20 0.46
PPARG P37231 1/20 0.42
GAA P10253 2/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
CYP19A1 P11511 1/20 0.36
PKM P14618 2/20 0.35
ALDH1A1 P00352 2/20 0.35
KDM4E B2RXH2 1/20 0.35
KMT2A Q03164 1/20 0.35
TDP1 Q9NUW8 1/20 0.34
CHRNB2 P17787 1/20 0.34
CHRNB4 P30926 1/20 0.34
CHRNA3 P32297 1/20 0.34
CHRNA4 P43681 1/20 0.34

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
SCHEMBL1297092 0.93 TP53 (0.41) TP53CYP3A4PPARGGAARAB9A
SCHEMBL780427 0.93 PPARG (0.44) TP53CYP3A4PPARGGAARAB9A
SCHEMBL1296710 0.93 TP53 (0.41) TP53CYP3A4PPARGGAARAB9A
SCHEMBL1297181 0.93 TP53 (0.41) TP53CYP3A4PPARGGAARAB9A
SCHEMBL1296925 0.93 CAPN9 (0.42) TP53CYP3A4PPARGGAARAB9A
SCHEMBL1296969 0.93 TP53 (0.41) TP53CYP3A4PPARGGAARAB9A
SCHEMBL1297085 0.93 TP53 (0.41) TP53CYP3A4PPARGGAARAB9A
SCHEMBL1296083 0.92 TP53 (0.40) TP53CYP3A4PPARGGAARAB9A
SCHEMBL1296323 0.92 TP53 (0.40) TP53CYP3A4PPARGGAARAB9A
SCHEMBL1296675 0.90 TP53 (0.39) TP53CYP3A4PPARGGAARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2838945-B1 COMPOSITION COMPRISING AT LEAST ONE BIODEGRADABLE POLYMER AND AT LEAST ONE PLASTICISER BIO ON SPA (IT) 2016-06-08 EP claimed
US-8283411-B2 Plasticised polyvinyl chloride EXXONMOBIL CHEMICAL PATENTS INC. (US) 2012-10-09 US claimed
US-20120071598-A1 Plasticised Polyvinyl Chloride EXXONMOBIL CHEMICAL PATENTS INC. 2012-03-22 US claimed
US-8084534-B2 Plasticised polyvinyl chloride EXXONMOBIL CHEMICAL PATENTS INC. (US) 2011-12-27 US claimed
US-20110040001-A1 Plasticised Polyvinyl Chloride EXXONMOBIL CHEMICAL PATENTS INC. 2011-02-17 US claimed
US-7337913-B2 Single piece closure device made of PVC BASF AKTIENGESELLSCHAFT (DE) 2008-03-04 US claimed
EP-1472312-B1 SINGLE PIECE CLOSURE DEVICE MADE OF PVC BASF AG (DE) 2006-11-15 EP claimed
EP-1192212-B1 USE OF CYCLOHEXANE POLYCARBOXYLIC ACIDS AS PLASTICIZERS IN THE PRODUCTION OF PLASTICS WHICH ARE RATED TOXICOLOGICALLY FAVOURABLE BASF AG (DE) 2006-01-04 EP claimed
US-20050106405-A1 Single piece closure device made of pvc BASF AKTIENGESELLSCHAFT (DE) 2005-05-19 US claimed
EP-1272033-B1 AGROTECHNICAL FORMULATION BASF AG (DE) 2004-06-09 EP claimed
US-6683030-B2 CONTAINING A CYCLOHEXANEPOLYCARBOXYLIC ACID ESTER, ESPECIALLY A DIISOALKYL 1,2-CYCLOHEXANEDICARBOXYLATE; A NONIONIC SURFACTANT; WATER; AND AN ACTIVE PLANT TREATMENT AGENT, E.G, HERBICIDE OR PLANT GROWTH REGULATOR BASF AKTIENGESELLSCHAFT (DE) 2004-01-27 US claimed
EP-1042273-B1 METHOD FOR HYDROGENATING BENZENE POLYCARBOXYLIC ACIDS OR DERIVATIVES THEREOF BY USING A CATALYST CONTAINING MACROPORES BASF AG (DE) 2003-05-07 EP claimed
US-20030069135-A1 Agrotechnical formulation BASF AKTIENGESELLSCHAFT (DE) 2003-04-10 US claimed
US-20020019559-A1 Hydrogenation of benzenepolycarboxylic acids or derivatives thereof using a catalyst containing macropores BRUNNER MELANIE (DE) 2002-02-14 US claimed
WO-2025262619-A1 RUBBER COMPOSITIONS BRIDGESTONE CORPORATION (JP) 2025-12-26 WO disclosed
EP-4667236-A1 RUBBER COMPOSITIONS BRIDGESTONE CORPORATION (JP) 2025-12-24 EP disclosed
US-20240352301-A1 METHANOL-FREE ORGANIC PEROXIDE EMULSION NOURYON CHEMICALS INTERNATIONAL B.V. (NL) 2024-10-24 US disclosed
US-20030069135-A1 Agrotechnical formulation BASF AKTIENGESELLSCHAFT (DE) 2003-04-10 US disclosed
US-20020019559-A1 Hydrogenation of benzenepolycarboxylic acids or derivatives thereof using a catalyst containing macropores BRUNNER MELANIE (DE) 2002-02-14 US disclosed
US-6284917-B1 Method for hydrogenating benzene polycarboxylic acids or derivatives thereof by using a catalyst containing macropores BASF AKTIENGESELLSCHAFT (DE) 2001-09-04 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-20030069135-A1 Agrotechnical formulation HACL2, CBR1, ACACA TP53 2707/4885CYP3A4 2067/4885PPARG 688/4885

“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.