SCHEMBL1056737

SCHEMBL1056737

CCCCCCCC(=O)OCOc1ccc2ccc(OCCCCN3CCN(c4cccc(Cl)c4Cl)CC3)cc2n1

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 3/20 0.60
DRD2 P14416 18/20 0.56
HTR2A P28223 13/20 0.56
HTR1A P08908 11/20 0.56
DRD1 P21728 1/20 0.54
DRD4 P21917 1/20 0.54
KCNH2 Q12809 1/20 0.51

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
SCHEMBL1055026 1.00 DRD3 (0.60) DRD3DRD2HTR2AHTR1ADRD1
SCHEMBL12930984 1.00 DRD3 (0.60) DRD3DRD2HTR2AHTR1ADRD1
SCHEMBL12930983 0.99 DRD3 (0.61) DRD3DRD2HTR2AHTR1ADRD1
SCHEMBL12930982 0.97 DRD3 (0.62) DRD3DRD2HTR2AHTR1ADRD1
SCHEMBL1055778 0.95 DRD3 (0.63) DRD3DRD2HTR2AHTR1ADRD1
SCHEMBL1055174 0.93 DRD3 (0.60) DRD3DRD2HTR2AHTR1ADRD1
SCHEMBL826019 0.92 DRD3 (0.62) DRD3DRD2HTR2AHTR1AKCNH2
SCHEMBL12931015 0.92 DRD3 (0.61) DRD3DRD2HTR2AHTR1ADRD1
SCHEMBL826012 0.92 DRD3 (0.63) DRD3DRD2HTR2AHTR1AKCNH2
SCHEMBL12930981 0.92 DRD3 (0.65) DRD3DRD2HTR2AHTR1ADRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2445343-B1 PRODRUGS OF NH-ACIDIC COMPOUNDS ALKERMES PHARMA IRELAND LTD (IE) 2021-08-04 EP disclosed
US-10723728-B2 Prodrugs of Nh-acidic compounds ALKERMES PHARMA IRELAND LIMITED (IE) 2020-07-28 US disclosed
US-10428058-B2 Prodrugs of NH-acidic compounds ALKERMES PHARMA IRELAND LIMITED (IE) 2019-10-01 US disclosed
US-20190284181-A9 PRODRUGS OF NH-ACIDIC COMPOUNDS JPMORGAN CHASE BANK, N.A. AS ADMINISTRATIVE AGENT 2019-09-19 US disclosed
US-20190031648-A1 PRODRUGS OF NH-ACIDIC COMPOUNDS ALKERMES PHARMA IRELAND LTD (IE) 2019-01-31 US disclosed
US-10040787-B2 Prodrugs of NH-acidic compounds ALKERMES PHARMA IRELAND LIMITED (IE) 2018-08-07 US disclosed
US-20170015659-A1 Prodrugs of NH-Acidic Compounds JPMORGAN CHASE BANK, N.A. AS ADMINISTRATIVE AGENT 2017-01-19 US disclosed
US-20150376143-A1 Prodrugs of NH-Acidic Compounds ALKERMES PHARMA IRELAND LTD (IE) 2015-12-31 US disclosed
US-9102618-B2 Prodrugs of NH-acidic compounds ALKERMES PHARMA IRELAND LIMITED (IE) 2015-08-11 US disclosed
US-20140221653-A1 Prodrugs of NH-Acidic Compounds ALKERMES PHARMA IRELAND LIMITED (IE) 2014-08-07 US disclosed
US-20110003828-A1 PRODRUGS OF NH-ACIDIC COMPOUNDS ALKERMES, INC. 2011-01-06 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 (9 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-20150376143-A1 Prodrugs of NH-Acidic Compounds SI, NAAA, NIT2 DRD3 4303/4885DRD2 4366/4885HTR2A 3348/4885
US-20190031648-A1 PRODRUGS OF NH-ACIDIC COMPOUNDS SI, NAAA, NIT2 DRD3 4303/4885DRD2 4366/4885HTR2A 3348/4885
US-20170015659-A1 Prodrugs of NH-Acidic Compounds SI, NAAA, NIT2 DRD3 4303/4885DRD2 4366/4885HTR2A 3348/4885
US-10040787-B2 Prodrugs of NH-acidic compounds SI, NAAA, NIT2 DRD3 4303/4885DRD2 4366/4885HTR2A 3348/4885
US-20190284181-A9 PRODRUGS OF NH-ACIDIC COMPOUNDS SI, NAAA, NIT2 DRD3 4303/4885DRD2 4366/4885HTR2A 3348/4885
US-10428058-B2 Prodrugs of NH-acidic compounds SI, NAAA, NIT2 DRD3 4303/4885DRD2 4366/4885HTR2A 3348/4885
US-20140221653-A1 Prodrugs of NH-Acidic Compounds SI, NAAA, NIT2 DRD3 4303/4885DRD2 4366/4885HTR2A 3348/4885
US-20110003828-A1 PRODRUGS OF NH-ACIDIC COMPOUNDS SI, NAAA, NIT2 DRD3 4303/4885DRD2 4366/4885HTR2A 3348/4885
US-10723728-B2 Prodrugs of Nh-acidic compounds SI, NAAA, NIT2 DRD3 4303/4885DRD2 4366/4885HTR2A 3348/4885

“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.