SCHEMBL20007878

SCHEMBL20007878

O=C(NCc1ccc(F)cc1F)c1cn2c(c(O)c1=O)C(=O)N1CC3CCCCN3C1C2

nearest known ligand 0.64

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC22A2 O15244 15/20 0.64
CYP3A4 P08684 1/20 0.59
TMEM97 Q5BJF2 1/20 0.59
ABCG2 Q9UNQ0 1/20 0.59

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
SCHEMBL29775480 1.00 SLC22A2 (0.64) SLC22A2CYP3A4TMEM97ABCG2
SCHEMBL82690 1.00 SLC22A2 (0.64) SLC22A2CYP3A4TMEM97ABCG2
SCHEMBL80970 1.00 SLC22A2 (0.64) SLC22A2CYP3A4TMEM97ABCG2
SCHEMBL29775462 1.00 SLC22A2 (0.64) SLC22A2CYP3A4TMEM97ABCG2
SCHEMBL19138006 1.00 SLC22A2 (0.64) SLC22A2CYP3A4TMEM97ABCG2
SCHEMBL19307745 1.00 SLC22A2 (0.64) SLC22A2CYP3A4TMEM97ABCG2
SCHEMBL86352 0.98 SLC22A2 (0.64) SLC22A2CYP3A4TMEM97ABCG2
SCHEMBL82075 0.98 SLC22A2 (0.64) SLC22A2CYP3A4TMEM97ABCG2
SCHEMBL80366 0.98 SLC22A2 (0.64) SLC22A2CYP3A4TMEM97ABCG2
SCHEMBL21356931 0.98 SLC22A2 (0.64) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3045206-B2 POLYCYCLIC CARBAMOYLPYRIDONE DERIVATIVE HAVING HIV INTEGRASE INHIBITORY ACTIVITY VIIV HEALTHCARE CO (US) 2023-02-15 EP disclosed
EP-3284520-B1 POLYCYCLIC CARBAMOYLPYRIDONE DERIVATIVE HAVING HIV INTEGRASE INHIBITORY ACTIVITY VIIV HEALTHCARE CO (US) 2019-06-05 EP disclosed
EP-3045206-B1 POLYCYCLIC CARBAMOYLPYRIDONE DERIVATIVE HAVING HIV INTEGRASE INHIBITORY ACTIVITY VIIV HEALTHCARE CO (US) 2018-03-28 EP disclosed