SCHEMBL17847528

SCHEMBL17847528

NC(=O)OCCCCN1CCN(c2nccc3ccccc23)CC1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 4/20 0.55
▸ DRD4 P21917 1/20 0.55
▸ HRH4 Q9H3N8 1/20 0.52
▸ HTR1A P08908 3/20 0.52
▸ HTR2A P28223 2/20 0.52
▸ HRH3 Q9Y5N1 2/20 0.48
▸ DRD3 P35462 2/20 0.48
▸ SORD Q00796 1/20 0.47
▸ HTR2C P28335 2/20 0.46
▸ HCAR2 Q8TDS4 1/20 0.44
▸ ADRA1A P35348 1/20 0.44
▸ HRH1 P35367 1/20 0.44
▸ HTR1D P28221 1/20 0.44
▸ HTR1B P28222 1/20 0.44
▸ SLC6A4 P31645 1/20 0.44

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
SCHEMBL17844983 0.80 HRH4 (0.63) DRD2DRD4HRH4HTR1ADRD3
SCHEMBL9224900 0.80 HRH4 (0.63) DRD2DRD4HRH4HTR1ADRD3
SCHEMBL8134047 0.78 HRH4 (0.64) DRD2DRD4HRH4DRD3SORD
SCHEMBL17847547 0.78 DRD2 (0.62) DRD2DRD4HRH4HTR1AHTR2A
SCHEMBL6714160 0.77 HRH4 (0.67) DRD2DRD4HRH4HTR1ASORD
SCHEMBL7520224 0.77 HRH4 (0.67) DRD2DRD4HRH4HTR1ADRD3
SCHEMBL6103440 0.75 DRD2 (0.61) DRD2DRD4HRH4HTR1AHTR2A
SCHEMBL9230400 0.75 DRD2 (0.48) DRD2DRD4HTR1AHTR2AHTR1D
SCHEMBL9227703 0.75 MAPT (0.49) DRD2DRD4HTR1AHTR1DHTR1B
SCHEMBL6711651 0.75 HRH4 (0.67) DRD2DRD4HRH4HTR1ADRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10369130-B2 Antibacterial compounds AZIEN DE CHIMICHE RIUNITE ANGELINI FRANCESCO A.C.R.A.F. S.p.A. (IT) 2019-08-06 — — US disclosed
US-20170368017-A1 ANTIBACTERIAL COMPOUNDS AZIENDE CHIMICHE RIUNITE ANGELINI FRANCESCO A.C.R.A.F. S.P.A. (IT) 2017-12-28 — — US disclosed
EP-3233826-A1 NEW ANTIBACTERIAL COMPOUNDS Aziende Chimiche Riunite Angelini Francesco A.C.R. (IT) 2017-10-25 — — EP disclosed
WO-2016096631-A1 NEW ANTIBACTERIAL COMPOUNDS AZIENDE CHIMICHE RIUNITE ANGELINI FRANCESCO A.C.R.A.F. S.P.A. (IT) 2016-06-23 — — 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-10369130-B2 Antibacterial compounds MRPL21, CLPP, NRDC DRD2 3384/4885DRD4 1835/4885HRH4 3610/4885
US-20170368017-A1 ANTIBACTERIAL COMPOUNDS MRPL21, CLPP, NRDC DRD2 3384/4885DRD4 1835/4885HRH4 3610/4885

“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.

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