SCHEMBL5364769

SCHEMBL5364769

CC(=O)c1c(F)cccc1N1CCNCC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.49
CYP2C19 P33261 2/20 0.49
CYP2C9 P11712 1/20 0.49
ADRB1 P08588 5/20 0.47
HTR1A P08908 4/20 0.46
DRD2 P14416 3/20 0.46
DRD3 P35462 3/20 0.46
HTR2A P28223 2/20 0.46
DRD4 P21917 1/20 0.46
HTR2C P28335 1/20 0.46
HTR6 P50406 3/20 0.45
SLC6A2 P23975 2/20 0.44
SLC6A4 P31645 2/20 0.44
SLC6A3 Q01959 1/20 0.44
HTR7 P34969 2/20 0.44
HTR3E A5X5Y0 2/20 0.44
HTR3B O95264 2/20 0.44
HTR3A P46098 2/20 0.44
HTR3D Q70Z44 2/20 0.44
HTR3C Q8WXA8 2/20 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
Tert-Butyl Formate SCHEMBL27656335 0.88 HTR6 (0.40) CYP1A2CYP2C19CYP2C9ADRB1HTR1A
SCHEMBL3692763 0.83 CYP1A2 (0.54) CYP1A2CYP2C19CYP2C9HTR1ADRD2
SCHEMBL5369150 0.82 ADRB1 (0.60) CYP1A2CYP2C19CYP2C9ADRB1HTR1A
SCHEMBL9120411 0.80 CYP1A2 (0.45) CYP1A2CYP2C19CYP2C9ADRB1HTR1A
SCHEMBL8251216 0.79 ADRB1 (0.47) CYP1A2CYP2C19CYP2C9ADRB1HTR1A
SCHEMBL18600525 0.77 MAPT (0.47) ADRB1HTR6HTR7
SCHEMBL17884461 0.76 ADRB1 (0.69) CYP1A2CYP2C9ADRB1HTR1ADRD2
SCHEMBL5371004 0.75 CYP1A2 (0.52) CYP1A2CYP2C19CYP2C9TSHRHSD17B10
SCHEMBL1441614 0.75 HTR1A (0.58) CYP1A2ADRB1HTR1ADRD2DRD3
SCHEMBL30839785 0.75 HTR1A (0.58) CYP1A2ADRB1HTR1ADRD2DRD3

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 CYP1A2 82/4885CYP2C19 393/4885CYP2C9 419/4885
US-20060287309-A1 [1,8]NAPHTHYRIDIN-2-ONES AND RELATED COMPOUNDS FOR THE TREATMENT OF SCHIZOPHRENIA DRD1, DRD2, DRD3 CYP1A2 82/4885CYP2C19 393/4885CYP2C9 419/4885
US-20060287310-A1 [1,8]NAPHTHYRIDIN-2-ONES AND RELATED COMPOUNDS FOR THE TREATMENT OF SCHIZOPHRENIA DRD1, DRD2, DRD3 CYP1A2 82/4885CYP2C19 393/4885CYP2C9 419/4885

“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.