SCHEMBL17718816

SCHEMBL17718816

Cc1ccc2nc(-c3ccccc3)c(CN3CCNC(=O)C3)n2c1

nearest known ligand 0.74

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SLC2A1 P11166 13/20 0.74
▸ SMN1; SMN2 Q16637 1/20 0.64
▸ SLC2A2 P11168 3/20 0.58
▸ KDM4E B2RXH2 1/20 0.57
▸ ALDH1A1 P00352 1/20 0.57
▸ HTT P42858 1/20 0.57
▸ NPSR1 Q6W5P4 1/20 0.57

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
SCHEMBL12819265 0.85 SLC2A1 (1.00) SLC2A1SLC2A2
SCHEMBL12818661 0.84 SLC2A1 (0.78) SLC2A1SLC2A2
SCHEMBL12818980 0.83 SLC2A1 (0.79) SLC2A1SLC2A2
SCHEMBL12819154 0.82 SLC2A1 (0.81) SLC2A1SLC2A2
SCHEMBL12819070 0.80 SLC2A1 (0.80) SLC2A1SMN1; SMN2KDM4EALDH1A1HTT
SCHEMBL12819406 0.79 SLC2A1 (0.73) SLC2A1SLC2A2
SCHEMBL12819251 0.79 SLC2A1 (0.72) SLC2A1SLC2A2
SCHEMBL17718803 0.78 SMN1; SMN2 (0.75) SLC2A1SMN1; SMN2KDM4EALDH1A1HTT
SCHEMBL17719055 0.78 SLC2A1 (0.80) SLC2A1SLC2A2
SCHEMBL17718991 0.77 SLC2A1 (0.85) SLC2A1SLC2A2

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-20160120863-A1 SLC2A TRANSPORTER INHIBITORS IOMET PHARMA LTD. (GB) 2016-05-05 — — US disclosed
US-20160120863-A1 SLC2A TRANSPORTER INHIBITORS IOMET PHARMA LTD. (GB) 2016-05-05 — — 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-20160120863-A1 SLC2A TRANSPORTER INHIBITORS SLCO1A2, SLCO2B1, SLCO2A1 SLC2A1 6/4885SMN1; SMN2 3724/4885SLC2A2 8/4885

“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.

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