SCHEMBL3523656

SCHEMBL3523656

O=C(NCc1ccc(F)cc1)c1cn2c(c(O)c1=O)C(=O)N(C1CCCOC1)C(O)C2

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC22A2 O15244 17/20 0.51
CYP3A4 P08684 1/20 0.51
TMEM97 Q5BJF2 1/20 0.51
ABCG2 Q9UNQ0 1/20 0.51

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
SCHEMBL19356184 0.89 SLC22A2 (0.66) SLC22A2CYP3A4TMEM97ABCG2
SCHEMBL3528486 0.86 SLC22A2 (0.48) SLC22A2CYP3A4TMEM97ABCG2
SCHEMBL2238466 0.80 SLC22A2 (0.51) SLC22A2CYP3A4TMEM97ABCG2
SCHEMBL2185540 0.80 SLC22A2 (0.50) SLC22A2CYP3A4TMEM97ABCG2
SCHEMBL3528399 0.79 SLC22A2 (0.49) SLC22A2CYP3A4TMEM97ABCG2
SCHEMBL83470 0.79 SLC22A2 (0.52) SLC22A2CYP3A4TMEM97ABCG2
SCHEMBL3522687 0.79 SLC22A2 (0.49) SLC22A2CYP3A4TMEM97ABCG2
SCHEMBL2185698 0.79 SLC22A2 (0.48) SLC22A2CYP3A4TMEM97ABCG2
SCHEMBL3527644 0.78 SLC22A2 (0.47) SLC22A2CYP3A4TMEM97ABCG2
SCHEMBL81225 0.78 SLC22A2 (0.51) SLC22A2CYP3A4TMEM97ABCG2

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-7858788-B2 Bicyclic carbamoylpyridone derivative having HIV integrase inhibitory activity SHIONOGI & CO., LTD. (JP) 2010-12-28 US disclosed