SCHEMBL21696352

SCHEMBL21696352

O=C(NCc1ccc(Cl)cc1F)c1cn2c(c(O)c1=O)C(=O)N1CCCOC1C2

nearest known ligand 0.74

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC22A2 O15244 16/20 0.64
CYP3A4 P08684 1/20 0.64
TMEM97 Q5BJF2 1/20 0.64
ABCG2 Q9UNQ0 1/20 0.64

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
SCHEMBL83236 0.93 SLC22A2 (0.73) SLC22A2CYP3A4TMEM97ABCG2
SCHEMBL17285475 0.93 SLC22A2 (0.73) SLC22A2CYP3A4TMEM97ABCG2
SCHEMBL20822030 0.93 SLC22A2 (0.73) SLC22A2CYP3A4TMEM97ABCG2
SCHEMBL21658027 0.92 SLC22A2 (0.62) SLC22A2CYP3A4TMEM97ABCG2
SCHEMBL18473323 0.92 SLC22A2 (0.64) SLC22A2CYP3A4TMEM97ABCG2
SCHEMBL19313899 0.91 SLC22A2 (0.72) SLC22A2CYP3A4TMEM97ABCG2
SCHEMBL24591288 0.90 SLC22A2 (0.59) SLC22A2CYP3A4TMEM97ABCG2
SCHEMBL21696398 0.90 SLC22A2 (0.59) SLC22A2CYP3A4TMEM97ABCG2
SCHEMBL21696452 0.88 SLC22A2 (0.55) SLC22A2CYP3A4TMEM97ABCG2
SCHEMBL19307750 0.88 SLC22A2 (0.75) 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-4122935-A1 POLYCYCLIC-CARBAMOYLPYRIDONE COMPOUNDS AND THEIR PHARMACEUTICAL USE Gilead Sciences, Inc. (US) 2023-01-25 EP disclosed
EP-3608325-B1 POLYCYCLIC-CARBAMOYLPYRIDONE COMPOUNDS AND THEIR PHARMACEUTICAL USE GILEAD SCIENCES INC (US) 2022-07-06 EP disclosed
EP-3608325-A1 POLYCYCLIC-CARBAMOYLPYRIDONE COMPOUNDS AND THEIR PHARMACEUTICAL USE Gilead Sciences, Inc. (US) 2020-02-12 EP disclosed