SCHEMBL1361112

SCHEMBL1361112

CON=C1C2CC3CC(C2)CC1C3

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
KDM4E B2RXH2 4/20 0.38
ALDH1A1 P00352 3/20 0.38
LMNA P02545 1/20 0.38
CHRM2 P08172 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36
NPC1 O15118 1/20 0.35
GAA P10253 3/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C19 P33261 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL6867416 0.75 MEN1 (0.33) MEN1KMT2AKDM4EALDH1A1LMNA
SCHEMBL3137075 0.75 MEN1 (0.33) MEN1KMT2A
SCHEMBL13785535 0.72 KDM4E (0.40) MEN1KMT2AKDM4EALDH1A1LMNA
SCHEMBL5051725 0.71 MEN1 (0.37) MEN1KMT2AKDM4ENPC1
SCHEMBL10798452 0.70 KDM4E (0.50) MEN1KMT2AKDM4EALDH1A1LMNA
SCHEMBL14192193 0.69 CHRM2 (0.34) CHRM2CHRM1CHRM3
SCHEMBL12421265 0.68 KMT2A (0.47) MEN1KMT2AKDM4EALDH1A1LMNA
SCHEMBL1072568 0.67 KDM4E (0.45) MEN1KMT2AKDM4EALDH1A1LMNA
SCHEMBL8398977 0.67 KDM4E (0.45) KDM4EALDH1A1LMNANPC1GAA
SCHEMBL14950267 0.67 ALDH1A1 (0.50) KDM4EALDH1A1LMNANPC1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12139470-B2 Trioxolane agents THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2024-11-12 US disclosed
US-20220411396-A1 TRIOXOLANE AGENTS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2022-12-29 US disclosed
US-20220411396-A1 TRIOXOLANE AGENTS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2022-12-29 US disclosed
US-20220017559-A1 CYCLIC PEROXIDES AS PRODRUGS FOR SELECTIVE DELIVERY OF AGENTS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2022-01-20 US disclosed
US-11072594-B2 Trioxolane agents THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-07-27 US disclosed
US-11072594-B2 Trioxolane agents THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-07-27 US disclosed
US-11014955-B2 Cyclic peroxides as prodrugs for selective delivery of agents THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-05-25 US disclosed
WO-2020240266-A1 NEW ENDOPEROXIDE COMPOUNDS, PROCESS FOR OBTAINING THEM AND USES THEREOF FOR CONTROL OF PERKINSIOSIS IN BIVALVES CCMAR - CENTRO DE CIÊNCIAS DO MAR UNIVERSIDADE DO ALGARVE (PT) 2020-12-03 WO disclosed
WO-2020240266-A1 NEW ENDOPEROXIDE COMPOUNDS, PROCESS FOR OBTAINING THEM AND USES THEREOF FOR CONTROL OF PERKINSIOSIS IN BIVALVES CCMAR - CENTRO DE CIÊNCIAS DO MAR UNIVERSIDADE DO ALGARVE (PT) 2020-12-03 WO disclosed
US-20200317714-A1 CYCLIC PEROXIDES AS PRODRUGS FOR SELECTIVE DELIVERY OF AGENTS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2020-10-08 US disclosed
US-20070021423-A1 Dual molecules containing peroxy derivative, the synthesis and therapeutic applications thereof CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2007-01-25 US disclosed
EP-1414813-B1 1,2,4-TRIOXOLANE ANTIMALARIALS MEDICINES MALARIA VENTURE MMV (CH) 2006-09-13 EP disclosed
US-20050256185-A1 Spiro and dispiro 1,2,4-trioxolane antimalarials MEDICINES FOR MALARIA VENTURE MMV (CH) 2005-11-17 US disclosed
CN-1626530-A Spiro and dispiro -1,2,4-trioxalane antimalarials MEDICINES MALARIA VENTURE MMV (CH) 2005-06-15 CN disclosed
US-6906205-B2 Spiro and dispiro 1,2,4-trioxolane antimalarials MEDICINES FOR MALARIA VENTURE MMV (CH) 2005-06-14 US disclosed
EP-1514871-A1 Dispiro 1,2,4 - trioxolane antimalarials Medicines for Malaria Venture (CH) 2005-03-16 EP disclosed
US-6825230-B2 PEROXY COMPOUNDS SUCH AS ADAMANTANE-2-SPIRO-3'-8'-((1'S)-10'-CAMPHORSULFONYL)-1',2',4'-TRIOXA-8' -AZASPIRO(4.5) DECANE, USED FOR PROPHYLAXIS OF MALARIA OR SCHISTOSOMIASIS INFECTIONS MEDICINES FOR MALARIA VENTURE MMV (CH) 2004-11-30 US disclosed
CN-1545508-A 1,2,4-trioxolane antimalarials ű��ҩ�﹫˾ 2004-11-10 CN disclosed
US-20040186168-A1 Such as spiroadamantane on one side and 4-substituted spiro-cyclohexyl on other side; structurally simple, nontoxic, easy synthesis, potent parasiticides MEDICINES FOR MALARIA VENTURE MMV (CH) 2004-09-23 US disclosed
US-20040039008-A1 Spiro and dispiro 1,2,4-trioxolane antimalarials MEDICINES FOR MALARIA VENTURES MMV (CH) 2004-02-26 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 (10 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-20220411396-A1 TRIOXOLANE AGENTS ABCB4, SLC10A1, SLC10A2 MEN1 2610/4885KMT2A 3654/4885KDM4E 4796/4885
US-11072594-B2 Trioxolane agents ABCB4, SLC10A1, SLC10A2 MEN1 2610/4885KMT2A 3654/4885KDM4E 4796/4885
US-12139470-B2 Trioxolane agents ABCB4, SLC10A1, SLC10A2 MEN1 2610/4885KMT2A 3654/4885KDM4E 4796/4885
US-11014955-B2 Cyclic peroxides as prodrugs for selective delivery of agents GPX4, PRDX1, PRDX3 MEN1 4056/4885KMT2A 3813/4885KDM4E 3845/4885
US-20070021423-A1 Dual molecules containing peroxy derivative, the synthesis and therapeutic applications thereof PRDX2, PRDX1, PRDX5 MEN1 3607/4885KMT2A 3568/4885KDM4E 2845/4885
US-20220017559-A1 CYCLIC PEROXIDES AS PRODRUGS FOR SELECTIVE DELIVERY OF AGENTS GPX4, PRDX1, PRDX3 MEN1 4056/4885KMT2A 3813/4885KDM4E 3845/4885
US-20040039008-A1 Spiro and dispiro 1,2,4-trioxolane antimalarials DHODH, THPO, SQLE MEN1 788/4885KMT2A 3704/4885KDM4E 4113/4885
US-20040186168-A1 Such as spiroadamantane on one side and 4-substituted spiro-cyclohexyl on other side; structurally simple, nontoxic, easy synthesis, potent parasiticides DHODH, SQLE, SULT1E1 MEN1 793/4885KMT2A 3756/4885KDM4E 3092/4885
US-20200317714-A1 CYCLIC PEROXIDES AS PRODRUGS FOR SELECTIVE DELIVERY OF AGENTS GPX4, PRDX1, GPX1 MEN1 4109/4885KMT2A 3571/4885KDM4E 3838/4885
US-20050256185-A1 Spiro and dispiro 1,2,4-trioxolane antimalarials DHODH, THPO, SQLE MEN1 788/4885KMT2A 3704/4885KDM4E 4113/4885

“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.