SCHEMBL4490126

SCHEMBL4490126

CCOC(=O)[C@@H]1CCC[C@@H]1N(Cc1ccc(F)cn1)C(=O)CC1=NS(=O)(=O)c2cc(NS(C)(=O)=O)ccc2N1

nearest known ligand 0.31

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CCNE1 P24864 2/20 0.31
CDK2 P24941 2/20 0.31
HTR2A P28223 5/20 0.31
CYP1A2 P05177 1/20 0.30
HTR2C P28335 1/20 0.30
CYP2C19 P33261 1/20 0.30
HTR2B P41595 1/20 0.30
KCNH2 Q12809 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
SCHEMBL13712232 1.00 CCNE1 (0.31) CCNE1CDK2HTR2ACYP1A2HTR2C
SCHEMBL13890009 0.91 ALDH1A1 (0.32) HTR2A
SCHEMBL4481255 0.91 ALDH1A1 (0.32) HTR2A
SCHEMBL4495326 0.90 MEN1 (0.33) CCNE1CDK2
SCHEMBL4493109 0.88 MMP2 (0.33) CYP1A2CYP2C19
SCHEMBL13712950 0.87 PKM (0.33)
SCHEMBL4484765 0.86 NPC1 (0.34) CYP1A2
SCHEMBL4488210 0.86 HTR2A (0.32) HTR2A
SCHEMBL13712219 0.86 HTR2A (0.32) HTR2A
SCHEMBL4480672 0.86 MMP2 (0.31)

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
US-7582626-B2 5,6-dihydro-1H-pyridin-2-one compounds ANADYS PHARMACEUTICALS, INC. (US) 2009-09-01 US disclosed
US-20090111798-A1 5,6-DIHYDRO-1H-PYRIDIN-2-ONE COMPOUNDS ANADYS PHARMACEUTICALS, INC. 2009-04-30 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-20090111798-A1 5,6-DIHYDRO-1H-PYRIDIN-2-ONE COMPOUNDS HAVCR2, PYGL, HCCS CCNE1 817/4885CDK2 110/4885HTR2A 2295/4885

“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.