SCHEMBL2854366

SCHEMBL2854366

O=C(NCc1ccccc1)c1cnn(Cc2ccccc2)c1

nearest known ligand 0.80

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KLKB1 P03952 19/20 0.80
KLK1 P06870 4/20 0.61

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
SCHEMBL2854565 0.94 KLKB1 (0.75) KLKB1KLK1
SCHEMBL2850615 0.92 KLKB1 (0.73) KLKB1KLK1
SCHEMBL22878729 0.89 KLKB1 (0.69) KLKB1KLK1
SCHEMBL25910310 0.89 KLKB1 (0.80) KLKB1KLK1
SCHEMBL1981938 0.89 KLKB1 (1.00) KLKB1KLK1
Hydrochloric Acid SCHEMBL1985633 0.88 KLKB1 (0.98) KLKB1KLK1
SCHEMBL22878728 0.88 KLKB1 (0.78) KLKB1KLK1
SCHEMBL13277118 0.87 KLKB1 (0.77) KLKB1KLK1
SCHEMBL13277121 0.87 KLKB1 (0.77) KLKB1KLK1
SCHEMBL13464658 0.87 KLKB1 (0.77) KLKB1KLK1

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
EP-1451160-B1 PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN ICAGEN INC (US) 2010-01-13 EP claimed
EP-1451160-B1 PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN ICAGEN INC (US) 2010-01-13 EP disclosed
US-20080064690-A1 PYRAZOLE-AMIDES AND -SULFONAMIDES ICAGEN, INC. (US) 2008-03-13 US disclosed
US-7223782-B2 Pyrazole-amides and -sulfonamides ICAGEN, INC. (US) 2007-05-29 US disclosed
US-20050049237-A1 Pyrazole-amides and -sulfonamides ICAGEN, INC. (US) 2005-03-03 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 (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-20080064690-A1 PYRAZOLE-AMIDES AND -SULFONAMIDES SCN3A, TRPV3, HCN3 KLKB1 4280/4885KLK1 4537/4885
US-20050049237-A1 Pyrazole-amides and -sulfonamides SCN3A, TRPV3, HCN3 KLKB1 4280/4885KLK1 4537/4885

“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.