SCHEMBL5012228

SCHEMBL5012228

[NH]S(=O)(=O)C1C=Cc2ccccc21

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.35
HTR6 P50406 1/20 0.35
BRD4 O60885 1/20 0.33
CCL2 P13500 1/20 0.33
CYP2D6 P10635 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
SCHEMBL9777608 0.83 HTR2A (0.38) HTR2AHTR6BRD4CCL2CYP2D6
SCHEMBL31131312 0.80 HTR2A (0.35) HTR2AHTR6BRD4CCL2CYP2D6
SCHEMBL2902860 0.80 HTR2A (0.39) HTR2AHTR6BRD4CCL2CYP2D6
SCHEMBL22932183 0.80 BRD4 (0.36) HTR2AHTR6BRD4CCL2CYP2D6
SCHEMBL2322179 0.80 HTR2A (0.35) HTR2AHTR6BRD4CCL2CYP2D6
SCHEMBL30232400 0.80 HTR2A (0.39) HTR2AHTR6BRD4CCL2CYP2D6
SCHEMBL14393119 0.72 HTR2A (0.35) HTR2AHTR6BRD4CCL2CYP2D6
SCHEMBL24654162 0.68 CYP2D6 (0.30) CYP2D6
SCHEMBL275865 0.67 HTR2A (0.41) HTR2AHTR6BRD4CCL2CYP2D6
SCHEMBL194747 0.67 HTR2A (0.38) HTR2AHTR6BRD4CCL2CYP2D6

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-1884513-A1 PYRAZOLE COMPOUND AND THERAPEUTIC AGENT FOR DIABETES COMPRISING THE SAME Japan Tobacco, Inc. (JP) 2008-02-06 EP disclosed
US-20070032529-A1 Pyrazole compounds and their use as antidiabetes agents JAPAN TOBACCO INC. (JP) 2007-02-08 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-20070032529-A1 Pyrazole compounds and their use as antidiabetes agents PYGL, GYS2, AGL HTR2A 4611/4885HTR6 3104/4885BRD4 2355/4885

“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.