SCHEMBL3023008

SCHEMBL3023008

COc1ccc2c(n1)N(c1cnc3c(c1)COCC3CNC(=O)O)C(=O)CN2

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 3/20 0.32
MTNR1A P48039 3/20 0.32
MTNR1B P49286 3/20 0.32
EGLN1 Q9GZT9 1/20 0.30

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
SCHEMBL3026655 0.77 KCNH2 (0.36) HTR2CMTNR1AMTNR1B
SCHEMBL3026890 0.77 KDM4C (0.40) HTR2CMTNR1AMTNR1B
SCHEMBL3020288 0.73 RIPK1 (0.36) HTR2CMTNR1AMTNR1B
SCHEMBL3024862 0.68 CA1 (0.39) HTR2CMTNR1AMTNR1B
SCHEMBL3016282 0.68
SCHEMBL3666949 0.67 KCNH2 (0.33)
SCHEMBL3723303 0.67
SCHEMBL3724329 0.64 KDM4C (0.31)
SCHEMBL3012194 0.64 RIPK1 (0.33)
SCHEMBL3724009 0.64 GAA (0.33) HTR2C

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
US-20100197679-A1 COMPOUNDS GLAXO GROUP LIMITED 2010-08-05 US disclosed
EP-2139898-A1 COMPOUNDS Glaxo Group Limited (GB) 2010-01-06 EP disclosed
WO-2008128961-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2008-10-30 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 (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-20100197679-A1 COMPOUNDS NRDC, MRPL21, NISCH HTR2C 2852/4885MTNR1A 4161/4885MTNR1B 3836/4885

“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.