SCHEMBL5368997

SCHEMBL5368997

O=c1ccc2ccc(OCCCCN3CCN(c4cccc5c4CCC5)CC3)nc2[nH]1

nearest known ligand 0.70

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 20/20 0.70
HTR2A P28223 20/20 0.70
HTR1A P08908 19/20 0.70
DRD1 P21728 1/20 0.48
DRD4 P21917 1/20 0.48
DRD5 P21918 1/20 0.48
HTR2C P28335 1/20 0.48
DRD3 P35462 1/20 0.48
HTR2B P41595 1/20 0.48

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
SCHEMBL5833560 0.99 DRD2 (0.69) DRD2HTR2AHTR1ADRD1DRD4
SCHEMBL5378973 0.98 DRD2 (0.70) DRD2HTR2AHTR1ADRD1DRD4
SCHEMBL5365392 0.89 DRD2 (0.68) DRD2HTR2AHTR1ADRD1DRD4
SCHEMBL5363539 0.89 DRD2 (0.68) DRD2HTR2AHTR1A
SCHEMBL5365411 0.89 DRD2 (0.68) DRD2HTR2AHTR1ADRD1DRD4
SCHEMBL5369508 0.89 HTR1A (0.67) DRD2HTR2AHTR1A
SCHEMBL5367369 0.89 DRD2 (0.67) DRD2HTR2AHTR1A
SCHEMBL5372450 0.89 DRD2 (0.67) DRD2HTR2AHTR1A
SCHEMBL5366764 0.88 DRD2 (0.69) DRD2HTR2AHTR1A
SCHEMBL5372304 0.88 DRD2 (0.69) DRD2HTR2AHTR1ADRD1DRD4

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-7160888-B2 [1,8]naphthyridin-2-ones and related compounds for the treatment of schizophrenia WARNER LAMBERT COMPANY LLC (US) 2007-01-09 US disclosed
US-20060287309-A1 [1,8]NAPHTHYRIDIN-2-ONES AND RELATED COMPOUNDS FOR THE TREATMENT OF SCHIZOPHRENIA WARNER-LAMBERT COMPANY LLC 2006-12-21 US disclosed
US-20060287310-A1 [1,8]NAPHTHYRIDIN-2-ONES AND RELATED COMPOUNDS FOR THE TREATMENT OF SCHIZOPHRENIA WARNER-LAMBERT COMPANY LLC 2006-12-21 US disclosed
US-20050043309-A1 [1,8]naphthyridin-2-ones and related compounds for the treatment of schizophrenia WARNER-LAMBERT COMPANY LLC 2005-02-24 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 (3 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-20050043309-A1 [1,8]naphthyridin-2-ones and related compounds for the treatment of schizophrenia DRD1, DRD2, DRD3 DRD2 2/4885HTR2A 328/4885HTR1A 191/4885
US-20060287309-A1 [1,8]NAPHTHYRIDIN-2-ONES AND RELATED COMPOUNDS FOR THE TREATMENT OF SCHIZOPHRENIA DRD1, DRD2, DRD3 DRD2 2/4885HTR2A 328/4885HTR1A 191/4885
US-20060287310-A1 [1,8]NAPHTHYRIDIN-2-ONES AND RELATED COMPOUNDS FOR THE TREATMENT OF SCHIZOPHRENIA DRD1, DRD2, DRD3 DRD2 2/4885HTR2A 328/4885HTR1A 191/4885

“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.