SCHEMBL5215396

SCHEMBL5215396

BrCCOc1cccc2ccoc12

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.41
SLC6A4 P31645 1/20 0.41
KCNA3 P22001 2/20 0.36
HTR1B P28222 2/20 0.35
EGLN1 Q9GZT9 1/20 0.35
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TRPA1 O75762 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL7688315 0.89 SLC6A4 (0.42) HTR1ASLC6A4KCNA3HTR1BHTR2A
SCHEMBL7834298 0.83 HTR1A (0.41) HTR1ASLC6A4KCNA3HTR1BEGLN1
SCHEMBL4180176 0.83 HTR1B (0.54) HTR1ASLC6A4KCNA3HTR1BEGLN1
SCHEMBL4313222 0.83 HTR1A (0.41) HTR1ASLC6A4KCNA3HTR1BEGLN1
SCHEMBL3789397 0.83 MCHR1 (0.46) HTR1ASLC6A4HTR1B
SCHEMBL3795511 0.81 MCHR1 (0.48) HTR1ASLC6A4HTR1B
SCHEMBL3796715 0.79 ADORA3 (0.49)
SCHEMBL7928500 0.78 NCF1 (0.40) HTR1ASLC6A4LMNA
SCHEMBL23544480 0.77 GAA (0.45) HTR1ASLC6A4LMNANPC1
SCHEMBL11811685 0.75 HTR1A (0.38) HTR1ASLC6A4KCNA3HTR1BEGLN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1330460-B1 BENZOXAZINONE DERIVATIVES, THEIR PREPARATION AND USE SMITHKLINE BEECHAM PLC (GB) 2007-03-21 EP disclosed
US-6939871-B2 Benzoxazinone derivatives, their preparation and use SMITHKLINE BEECHAM P.L.C. (GB) 2005-09-06 US disclosed
US-20040063704-A1 Benzoxazinone derivatives, their preparation and use SMITHKLINE BEECHAM P.L.C (GB) 2004-04-01 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 (1 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-20040063704-A1 Benzoxazinone derivatives, their preparation and use CYP2B6, CBR1, CYP2A6 HTR1A 307/4885SLC6A4 1029/4885KCNA3 557/4885

“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.