SCHEMBL21708756

SCHEMBL21708756

CCCC(F)OC(=O)CCC(C)(CN)c1cc(F)ccc1Cl

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGFR P43088 3/20 0.33
SLC6A3 Q01959 5/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
RBP4 P02753 1/20 0.31

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
SCHEMBL21708642 0.86 TAS1R3 (0.34) PTGFRL3MBTL1
SCHEMBL21708659 0.82 SLC6A3 (0.32) SLC6A3L3MBTL1RBP4
SCHEMBL21656604 0.81 NR3C2 (0.37) PTGFRL3MBTL1
SCHEMBL21708644 0.80 TAS1R3 (0.33) PTGFRL3MBTL1
SCHEMBL21632116 0.78 PTGFR (0.46) PTGFRRBP4
SCHEMBL21708537 0.77 PTGFR (0.33) PTGFRSLC6A3L3MBTL1
Hydrochloric Acid SCHEMBL21708672 0.75 NR3C1 (0.36)
SCHEMBL21708704 0.75 TAS1R3 (0.33) L3MBTL1
SCHEMBL21708772 0.74 PTGFR (0.34) PTGFR
Hydrochloric Acid SCHEMBL21708632 0.73 PTGFR (0.33) PTGFR

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
EP-3609869-A1 SUBSTITUTED N-ARYLETHYL-2-ARYLQUINOLINE-4-CARBOXAMIDES AND USE THEREOF Bayer Aktiengesellschaft (DE) 2020-02-19 EP disclosed