SCHEMBL5382774

SCHEMBL5382774

O=c1ccc2cnc(NCCCCN3CCN(c4cccc(Cl)c4Cl)CC3)cc2[nH]1

nearest known ligand 0.72

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 18/20 0.72
HTR1A P08908 7/20 0.72
HTR2A P28223 7/20 0.72
DRD3 P35462 7/20 0.60
ADRA1A P35348 5/20 0.60
KCNH2 Q12809 3/20 0.59
HRH4 Q9H3N8 2/20 0.59
FGFR1 P11362 1/20 0.56
SRC P12931 1/20 0.56
HTR7 P34969 4/20 0.55
HTR6 P50406 4/20 0.55
DRD4 P21917 1/20 0.53

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
SCHEMBL5379573 0.84 DRD2 (1.00) DRD2HTR1AHTR2ADRD3ADRA1A
SCHEMBL8423 0.80 DRD2 (1.00) DRD2HTR1AHTR2ADRD3ADRA1A
SCHEMBL30552363 0.80 DRD2 (1.00) DRD2HTR1AHTR2ADRD3ADRA1A
SCHEMBL29549434 0.80 DRD2 (1.00) DRD2HTR1AHTR2ADRD3ADRA1A
SCHEMBL30839783 0.80 DRD2 (0.72) DRD2HTR1AHTR2ADRD3DRD4
SCHEMBL29176254 0.80 DRD2 (0.72) DRD2HTR1AHTR2ADRD3DRD4
SCHEMBL30964304 0.79 DRD2 (0.98) DRD2HTR1AHTR2ADRD3ADRA1A
Hydrochloric Acid SCHEMBL29923538 0.79 DRD2 (0.98) DRD2HTR1AHTR2ADRD3ADRA1A
Hydrochloric Acid SCHEMBL29365523 0.79 DRD2 (0.98) DRD2HTR1AHTR2ADRD3ADRA1A
SCHEMBL8148606 0.79 FGFR1 (0.64) DRD2HTR1AHTR2AFGFR1SRC

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 6 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
EP-1660497-A1 [ 1,8]NAPHTHYRIDIN-2-ONES AND RELATED COMPOUNDS FOR THE TREATMENT OF SCHIZOPHRENIA Warner-Lambert Company LLC (US) 2006-05-31 EP disclosed
WO-2005019215-A1 [1,8]NAPHTHYRIDIN-2-ONES AND RELATED COMPOUNDS FOR THE TREATMENT OF SCHIZOPHRENIA WARNER-LAMBERT COMPANY LLC (US) 2005-03-03 WO 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 2/4885HTR1A 191/4885HTR2A 328/4885
US-20060287309-A1 [1,8]NAPHTHYRIDIN-2-ONES AND RELATED COMPOUNDS FOR THE TREATMENT OF SCHIZOPHRENIA DRD1, DRD2, DRD3 DRD2 2/4885HTR1A 191/4885HTR2A 328/4885
US-20060287310-A1 [1,8]NAPHTHYRIDIN-2-ONES AND RELATED COMPOUNDS FOR THE TREATMENT OF SCHIZOPHRENIA DRD1, DRD2, DRD3 DRD2 2/4885HTR1A 191/4885HTR2A 328/4885

“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.