SCHEMBL28447347

SCHEMBL28447347

CCc1nc2cc(C)c(F)cc2c(CCC(=O)O)c1C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
KMT2A Q03164 5/20 0.35
MEN1 O00255 4/20 0.35
KDM4E B2RXH2 6/20 0.34
L3MBTL1 Q9Y468 3/20 0.34
RXFP1 Q9HBX9 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
FFAR1 O14842 3/20 0.34
FFAR4 Q5NUL3 2/20 0.34
LMNA P02545 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
S1PR1 P21453 1/20 0.33
HSD17B10 Q99714 2/20 0.33
GPR17 Q13304 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GLA P06280 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL28448820 0.94 GAA (0.35) GAANPSR1KMT2AMEN1KDM4E
SCHEMBL28442795 0.93 DPP4 (0.35) GAAKMT2AMEN1KDM4EL3MBTL1
SCHEMBL28453316 0.85 SLC22A12 (0.38) GAANPSR1KMT2AMEN1KDM4E
SCHEMBL28448524 0.81 GAA (0.34) GAAKMT2AMEN1KDM4EL3MBTL1
SCHEMBL28442805 0.79 SLC22A12 (0.35) GAAKMT2AMEN1KDM4EL3MBTL1
SCHEMBL28443600 0.78 KDM4E (0.32) GAAKMT2AMEN1KDM4EL3MBTL1
SCHEMBL28450315 0.78 DPP4 (0.35) GAAKMT2AMEN1KDM4EL3MBTL1
SCHEMBL28446607 0.76 MEN1 (0.33) GAAKMT2AMEN1KDM4EL3MBTL1
SCHEMBL28447349 0.75 GAA (0.36) GAANPSR1KMT2AMEN1KDM4E
SCHEMBL28448821 0.74 AKR1C3 (0.35) GAAKMT2AMEN1KDM4EL3MBTL1

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
CN-108689928-B Quinoline derivative and preparation method and application thereof 山东省联合农药工业有限公司 2020-05-26 CN claimed