SCHEMBL2818795

SCHEMBL2818795

O=c1ccc2ccc(F)c3c2n1CC(O)C3

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 2/20 0.35
DRD2 P14416 1/20 0.35
AADAT Q8N5Z0 1/20 0.33
KCNH2 Q12809 1/20 0.31

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
SCHEMBL2818619 0.82 HTR1A (0.35) HTR1ADRD2AADATKCNH2
SCHEMBL3781589 0.82 AADAT (0.36) HTR1ADRD2AADATKCNH2
SCHEMBL3403994 0.81 CDK4 (0.37) HTR1ADRD2AADATKCNH2
SCHEMBL3777717 0.81 TSHR (0.43) HTR1ADRD2
SCHEMBL3778731 0.78 BPTF (0.43) HTR1ADRD2AADATKCNH2
SCHEMBL4554113 0.72 NOTUM (0.32)
SCHEMBL31057621 0.72 NOTUM (0.32)
SCHEMBL13492064 0.69 KCNH2 (0.39) HTR1ADRD2KCNH2
SCHEMBL2288096 0.69 KCNH2 (0.39) HTR1ADRD2KCNH2
SCHEMBL2292976 0.69 KCNH2 (0.39) HTR1ADRD2KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2041145-B1 AZATRICYCLIC COMPOUNDS AND THEIR USE GLAXO GROUP LTD (GB) 2010-10-27 EP disclosed
US-20100004230-A1 AZATRICYCLIC COMPOUNDS AND THEIR USE GLAXO GROUP LIMITED (GB) 2010-01-07 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-20100004230-A1 AZATRICYCLIC COMPOUNDS AND THEIR USE AADAC, AZI2, NNMT HTR1A 2225/4885DRD2 1198/4885AADAT 692/4885

“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.