SCHEMBL21708615

SCHEMBL21708615

CCCC(F)OC(=O)CCC(CN)c1c(Cl)ccc(F)c1F

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGFR P43088 3/20 0.35
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
GAA P10253 1/20 0.30

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
SCHEMBL21708481 0.87 GAA (0.32) PTGFRGAA
SCHEMBL21708770 0.87 PTGFR (0.35) PTGFRMEN1KMT2A
SCHEMBL21708507 0.86 PTGFR (0.33) PTGFRMEN1KMT2AGAA
SCHEMBL21708612 0.86 TAS1R3 (0.32) MEN1KMT2AGAA
SCHEMBL21708727 0.85 PTGFR (0.30) PTGFR
SCHEMBL21708613 0.82 TAS1R3 (0.33) PTGFR
SCHEMBL21708537 0.82 PTGFR (0.33) PTGFRGAA
SCHEMBL21708563 0.81 MEN1 (0.31) MEN1KMT2A
SCHEMBL21656225 0.81 PTGFR (0.34) PTGFRMEN1KMT2A
SCHEMBL21632069 0.78 PTGFR (0.43) PTGFRMEN1KMT2A

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 2 patents. 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
EP-3609870-A1 SUBSTITUTED N-ARYLETHYL-2-AMINOQUINOLINE-4-CARBOXAMIDES AND USE THEREOF Bayer Aktiengesellschaft (DE) 2020-02-19 EP disclosed