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SCHEMBL18320757

SCHEMBL18320757

Cc1c(NC(=O)c2cc(-c3ncnn3C)nc3ccccc23)c(C(F)(F)F)nn1Cc1ccc(C#N)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SLC2A1 P11166 20/20 1.00
▸ SLC2A3 P11169 20/20 1.00
▸ SLC2A4 P14672 20/20 1.00
▸ SLC2A2 P11168 9/20 1.00
▸ ADORA3 P0DMS8 1/20 0.60
▸ HRH2 P25021 1/20 0.60
▸ HRH1 P35367 1/20 0.60
▸ PTGER4 P35408 1/20 0.60

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
SCHEMBL18320843 0.91 SLC2A1 (0.84) SLC2A1SLC2A3SLC2A4SLC2A2ADORA3
SCHEMBL18321236 0.89 SLC2A1 (0.80) SLC2A1SLC2A3SLC2A4SLC2A2ADORA3
SCHEMBL18321268 0.88 SLC2A1 (0.78) SLC2A1SLC2A3SLC2A4SLC2A2ADORA3
SCHEMBL18320862 0.87 SLC2A1 (0.90) SLC2A1SLC2A3SLC2A4SLC2A2ADORA3
SCHEMBL18320594 0.86 SLC2A1 (1.00) SLC2A1SLC2A3SLC2A4SLC2A2ADORA3
SCHEMBL18320953 0.86 SLC2A1 (0.89) SLC2A1SLC2A3SLC2A4SLC2A2ADORA3
SCHEMBL18320717 0.85 SLC2A1 (1.00) SLC2A1SLC2A3SLC2A4SLC2A2ADORA3
SCHEMBL18320583 0.85 SLC2A1 (1.00) SLC2A1SLC2A3SLC2A4SLC2A2ADORA3
SCHEMBL18321274 0.84 SLC2A1 (1.00) SLC2A1SLC2A3SLC2A4SLC2A2ADORA3
SCHEMBL18320767 0.84 SLC2A1 (0.85) SLC2A1SLC2A3SLC2A4SLC2A2ADORA3

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
WO-2016202898-A1 GLUCOSE TRANSPORT INHIBITORS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-12-22 — — WO claimed