SCHEMBL20534677

SCHEMBL20534677

CC(CCC(=O)O)c1ccccc1OC(F)F

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGFR P43088 3/20 0.43
PDE4A P27815 2/20 0.40
PDE4B Q07343 2/20 0.40
PDE4C Q08493 2/20 0.40
PDE4D Q08499 2/20 0.40
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
LMNA P02545 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
DAGLA Q9Y4D2 1/20 0.38
MAPT P10636 1/20 0.38
TSHR P16473 1/20 0.38

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
SCHEMBL20535171 0.84 LMNA (0.54) KMT2AMEN1SMN1; SMN2LMNAL3MBTL1
SCHEMBL19304126 0.83 MEN1 (0.38) PDE4APDE4BPDE4CPDE4DKMT2A
SCHEMBL20534572 0.81 FFAR4 (0.45) PTGFRSMN1; SMN2LMNA
SCHEMBL21631921 0.80 PTGFR (0.39) PTGFRPDE4APDE4BPDE4CPDE4D
SCHEMBL21632005 0.80 PTGFR (0.46) PTGFRPDE4APDE4BPDE4CPDE4D
SCHEMBL27613401 0.79 CYSLTR2 (0.42) LMNAL3MBTL1TSHR
SCHEMBL20534638 0.79 KMT2A (0.41) PDE4APDE4BPDE4CPDE4DKMT2A
SCHEMBL27728236 0.76 CPA3 (0.45) KMT2AMEN1SMN1; SMN2TSHR
SCHEMBL18304343 0.76 PTGS2 (0.47) KMT2AMEN1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL22186816 0.76 TSHR (0.50) KMT2AMEN1RAB9ASMN1; SMN2LMNA

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
WO-2018189011-A1 SUBSTITUTED N-ARYLETHYL-2-ARYLQUINOLINE-4-CARBOXAMIDES AND USE THEREOF BAYER AKTIENGESELLSCHAFT (DE) 2018-10-18 WO disclosed