SCHEMBL6079796

SCHEMBL6079796

COc1cc(F)c2ncc(Cl)c(CCN3CC[C@H](NC(=O)O)[C@@H](O)C3)c2c1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 4/20 0.53
FPR1 P21462 2/20 0.40
KCNH2 Q12809 8/20 0.39
CDK4 P11802 2/20 0.38
CCND1 P24385 2/20 0.38
CCND3 P30281 2/20 0.38
CDK6 Q00534 2/20 0.38
FPR2 P25090 1/20 0.38

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
SCHEMBL6079334 1.00 SLC2A1 (0.53) SLC2A1FPR1KCNH2CDK4CCND1
SCHEMBL6079786 1.00 SLC2A1 (0.53) SLC2A1FPR1KCNH2CDK4CCND1
SCHEMBL6079343 1.00 SLC2A1 (0.53) SLC2A1FPR1KCNH2CDK4CCND1
SCHEMBL5746446 0.92 SLC2A1 (0.53) SLC2A1FPR1KCNH2FPR2
SCHEMBL6079978 0.87 SLC2A1 (0.63) SLC2A1KCNH2
SCHEMBL6079813 0.85 SLC2A1 (0.55) SLC2A1KCNH2CDK4CCND1CCND3
SCHEMBL6079906 0.85 SLC2A1 (0.55) SLC2A1KCNH2CDK4CCND1CCND3
SCHEMBL5745036 0.85 SLC2A1 (0.55) SLC2A1KCNH2CDK4CCND1CCND3
Carbamic Acid SCHEMBL5746918 0.81 SLC2A1 (0.57) SLC2A1KCNH2
SCHEMBL6080284 0.81 SLC2A1 (0.78) SLC2A1KCNH2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060041123-A1 Antibacterial agents GLAXO GROUP LIMITED (GB) 2006-02-23 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-20060041123-A1 Antibacterial agents NQO2, NRDC, IFNG SLC2A1 4409/4885FPR1 1215/4885KCNH2 3365/4885

“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.