SCHEMBL10281118

SCHEMBL10281118

O=C(CCCCCCCCCCC(=O)OCN1C(=O)CCc2ccc(OCCCCN3CCN(c4cccc(Cl)c4Cl)CC3)cc21)OCN1C(=O)CCc2ccc(OCCCCN3CCN(c4cccc(Cl)c4Cl)CC3)cc21

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 17/20 0.59
HTR2A P28223 8/20 0.59
HTR1A P08908 7/20 0.59
DRD4 P21917 3/20 0.59
DRD3 P35462 3/20 0.59
DRD1 P21728 2/20 0.59
DRD5 P21918 2/20 0.59
HTR2C P28335 2/20 0.59
HTR2B P41595 2/20 0.59
HTR3E A5X5Y0 1/20 0.59
MEN1 O00255 1/20 0.59
MLNR O43193 1/20 0.59
HTR3B O95264 1/20 0.59
ABCB11 O95342 1/20 0.59
ESR1 P03372 1/20 0.59
PGR P06401 1/20 0.59
ADRB2 P07550 1/20 0.59
CHRM2 P08172 1/20 0.59
ABCB1 P08183 1/20 0.59
ADRB1 P08588 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
SCHEMBL10281590 1.00 DRD2 (0.59) DRD2HTR2AHTR1ADRD4DRD3
SCHEMBL10281475 1.00 DRD2 (0.59) DRD2HTR2AHTR1ADRD4DRD3
SCHEMBL19849425 0.98 DRD2 (0.60) DRD2HTR2AHTR1ADRD4DRD3
SCHEMBL19835201 0.97 DRD2 (0.56) DRD2HTR2AHTR1ADRD4DRD3
SCHEMBL11925283 0.97 DRD2 (0.61) DRD2HTR2AHTR1ADRD4DRD3
SCHEMBL1044545 0.96 DRD2 (0.56) DRD2HTR2AHTR1ADRD4DRD3
SCHEMBL1044327 0.96 DRD2 (0.56) DRD2HTR2AHTR1ADRD4DRD3
Aripiprazole Lauroxil SCHEMBL1044330 0.96 DRD2 (0.56) DRD2HTR2AHTR1ADRD4DRD3
SCHEMBL17132405 0.96 DRD2 (0.56) DRD2HTR2AHTR1ADRD4DRD3
SCHEMBL17132407 0.96 DRD2 (0.56) DRD2HTR2AHTR1ADRD4DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10584099-B2 Multi-API loading prodrugs ALKERMES PHARMA IRELAND LIMITED (IE) 2020-03-10 US disclosed
US-20180194732-A1 MULTI-API LOADING PRODRUGS JPMORGAN CHASE BANK, N.A. AS ADMINISTRATIVE AGENT 2018-07-12 US disclosed
US-20180194732-A1 MULTI-API LOADING PRODRUGS JPMORGAN CHASE BANK, N.A. AS ADMINISTRATIVE AGENT 2018-07-12 US disclosed
US-20180194732-A1 MULTI-API LOADING PRODRUGS JPMORGAN CHASE BANK, N.A. AS ADMINISTRATIVE AGENT 2018-07-12 US disclosed
EP-2655314-B1 MULTI-API LOADING PRODRUGS ALKERMES PHARMA IRELAND LTD (IE) 2018-02-07 EP disclosed
EP-2655314-B1 MULTI-API LOADING PRODRUGS ALKERMES PHARMA IRELAND LTD (IE) 2018-02-07 EP disclosed
US-20160024011-A1 Multi-API Loading Prodrugs ALKERMES PHARMA IRELAND LTD (IE) 2016-01-28 US disclosed
US-20160024011-A1 Multi-API Loading Prodrugs ALKERMES PHARMA IRELAND LTD (IE) 2016-01-28 US disclosed
US-20160024011-A1 Multi-API Loading Prodrugs ALKERMES PHARMA IRELAND LTD (IE) 2016-01-28 US disclosed
US-20120202823-A1 Multi-API Loading Prodrugs ALKERMES, INC. 2012-08-09 US disclosed
US-20120202823-A1 Multi-API Loading Prodrugs ALKERMES, INC. 2012-08-09 US disclosed
WO-2012088441-A1 MULTI- API LOADING PRODRUGS ALKERMES, INC. (US) 2012-06-28 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 (4 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-20160024011-A1 Multi-API Loading Prodrugs AADAC, PAICS, ABCG2 DRD2 3840/4885HTR2A 1784/4885HTR1A 2901/4885
US-10584099-B2 Multi-API loading prodrugs AADAC, PAICS, ABCG2 DRD2 3840/4885HTR2A 1784/4885HTR1A 2901/4885
US-20120202823-A1 Multi-API Loading Prodrugs AADAC, PAICS, ABCG2 DRD2 3840/4885HTR2A 1784/4885HTR1A 2901/4885
US-20180194732-A1 MULTI-API LOADING PRODRUGS AADAC, PAICS, ABCG2 DRD2 3840/4885HTR2A 1784/4885HTR1A 2901/4885

“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.