SCHEMBL4174481

SCHEMBL4174481

Cc1ccc2c(N3CCN(CC(=O)c4ccc5c(c4)N(C)CC(=O)O5)CC3)cccc2n1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.51
HTR1D P28221 18/20 0.51
HTR1A P08908 16/20 0.51
HTR1B P28222 16/20 0.51
KCNH2 Q12809 7/20 0.51
SLC6A4 P31645 5/20 0.51
DRD2 P14416 5/20 0.49
HTR2A P28223 4/20 0.49
HTR2C P28335 4/20 0.49
HTR2B P41595 4/20 0.49
CYP2C9 P11712 1/20 0.49
HTR7 P34969 4/20 0.49
DRD3 P35462 4/20 0.49
HTR6 P50406 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
SCHEMBL4178103 0.92 HTR1D (0.50) HTR1DHTR1AHTR1BKCNH2SLC6A4
SCHEMBL4180284 0.81 HTR1D (0.48) HTR1DHTR1AHTR1BKCNH2SLC6A4
Hydrochloric Acid SCHEMBL4174485 0.81 HTR1D (0.47) HTR1DHTR1AHTR1BKCNH2SLC6A4
SCHEMBL4174680 0.80 HTR1D (0.73) HTR1DHTR1AHTR1BKCNH2SLC6A4
Hydrochloric Acid SCHEMBL4174718 0.80 HTR1D (0.72) HTR1DHTR1AHTR1BKCNH2SLC6A4
SCHEMBL2882966 0.76 HTR1A (0.71) HTR1DHTR1AHTR1BKCNH2DRD2
SCHEMBL4174265 0.72 HTR1D (0.73) HTR1DHTR1AHTR1BKCNH2SLC6A4
SCHEMBL4167331 0.72 HTR1D (0.72) HTR1DHTR1AHTR1BKCNH2SLC6A4
SCHEMBL2304702 0.71 HTR1D (0.53) MAPTHTR1DHTR1AHTR1BKCNH2
SCHEMBL4176618 0.71 HTR1D (0.72) HTR1DHTR1AHTR1BKCNH2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060264429-A1 Benzoxazinone derivatives, preparation thereof and uses in the treatment of cns and other disorders GLAXO GROUP LIMITED (GB) 2006-11-23 US claimed
US-20090076274-A1 BENZOXAZINONE DERIVATIVES, PREPARATION THEREOF AND USES IN THE TREATMENT OF CNS AND OTHER DISORDERS GLAXO GROUP LIMITED 2009-03-19 US disclosed
US-20060264429-A1 Benzoxazinone derivatives, preparation thereof and uses in the treatment of cns and other disorders GLAXO GROUP LIMITED (GB) 2006-11-23 US disclosed
EP-1562917-A1 BENZOXAZINONE DERIVATIVES, PREPARATION THEREOF AND USES IN THE TREATMENT OF CNS AND OTHER DISORDERS GLAXO GROUP LIMITED (GB) 2005-08-17 EP disclosed
WO-2004046124-A1 BENZOXAZINONE DERIVATIVES, PREPARATION THEREOF AND USES IN THE TREATMENT OF CNS AND OTHER DISORDERS GLAXO GROUP LIMITED (GB) 2004-06-03 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-20060264429-A1 Benzoxazinone derivatives, preparation thereof and uses in the treatment of cns and other disorders XDH, CYP4X1, PDHX MAPT 2057/4885HTR1D 75/4885HTR1A 47/4885
US-20090076274-A1 BENZOXAZINONE DERIVATIVES, PREPARATION THEREOF AND USES IN THE TREATMENT OF CNS AND OTHER DISORDERS XDH, CYP4X1, PDHX MAPT 1924/4885HTR1D 569/4885HTR1A 476/4885

“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.