SCHEMBL10201463

SCHEMBL10201463

COC(=O)NC(C#C[Si](C)(C)C)(CN1CCc2ccsc2C1=O)C(=O)OC

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.33
DRD2 P14416 1/20 0.33
HTR2A P28223 1/20 0.33
KMT2A Q03164 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
SCHEMBL10201462 1.00 HTR1A (0.33) HTR1ADRD2HTR2AKMT2A
SCHEMBL10264333 0.89 KMT2A (0.31) HTR1ADRD2HTR2AKMT2A
SCHEMBL10264564 0.82 HTR1A (0.36) HTR1ADRD2HTR2AKMT2A
SCHEMBL13201492 0.81 DRD2 (0.41) DRD2HTR2A
SCHEMBL13201489 0.81 AOC3 (0.40)
SCHEMBL13895587 0.74 ADAM17 (0.34)
SCHEMBL10201426 0.72 TNF (0.42)
SCHEMBL12139552 0.70
SCHEMBL10201424 0.70 LRRK2 (0.36)
SCHEMBL14980155 0.69 ADAM17 (0.30)

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-8569336-B2 Compounds for the treatment of inflammatory disorders TONG LING (US) 2013-10-29 US disclosed
US-8569336-B2 Compounds for the treatment of inflammatory disorders TONG LING (US) 2013-10-29 US disclosed
US-20120015926-A1 COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISORDERS TONG LING (US) 2012-01-19 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-20120015926-A1 COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISORDERS TNF, ADAMTS1, ADAMTS7 HTR1A 4477/4885DRD2 4803/4885HTR2A 4604/4885

“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.