SCHEMBL3521604

SCHEMBL3521604

CC(C)OCCCN1CC(O)n2cc(C(=O)NCc3ccc(F)cc3)c(=O)c(O)c2C1=O

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
POU2F2 P09086 3/20 0.43
LIPG Q9Y5X9 1/20 0.41

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
SCHEMBL3528387 0.88 POU2F2 (0.47) POU2F2LIPG
SCHEMBL2185912 0.85 LIPG (0.42) LIPG
SCHEMBL3524919 0.85 SLC22A2 (0.43)
SCHEMBL3524024 0.84 POU2F2 (0.44) POU2F2
SCHEMBL2186003 0.84 POU2F2 (0.45) POU2F2
SCHEMBL2187036 0.81 SLC22A2 (0.45)
SCHEMBL2186404 0.80 POU2F2 (0.47) POU2F2
SCHEMBL2184785 0.80 LIPG (0.43) LIPG
SCHEMBL2187748 0.76 LIPG (0.45) LIPG
SCHEMBL8932593 0.76 SLC22A2 (0.42) LIPG

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