SCHEMBL5332473

SCHEMBL5332473

CCOC(=O)C1=C2NCCCC2CC=C1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.35
TSHR P16473 1/20 0.35
KMT2A Q03164 3/20 0.35
ALDH1A1 P00352 3/20 0.35
MAPT P10636 3/20 0.35
KDM4E B2RXH2 3/20 0.35
CSNK1D P48730 1/20 0.34
L3MBTL1 Q9Y468 3/20 0.34
TDP1 Q9NUW8 2/20 0.34
ADRA1D P25100 1/20 0.34
ADRA1A P35348 1/20 0.34
ADRA1B P35368 1/20 0.34
ADORA3 P0DMS8 3/20 0.34
MEN1 O00255 2/20 0.33
PLAT P00750 1/20 0.33
FUCA1 P04066 2/20 0.33
GLB1 P16278 1/20 0.33
ALOX15 P16050 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
SCHEMBL7999773 0.92 PLAT (0.37) LMNATSHRKMT2AALDH1A1MAPT
SCHEMBL5332950 0.80 MEN1 (0.37) LMNAKMT2AALDH1A1MAPTADRA1A
SCHEMBL6658826 0.78 TSHR (0.37) LMNATSHRKMT2AALDH1A1MAPT
SCHEMBL3125735 0.77 PARP1 (0.33) KMT2AALDH1A1MAPTKDM4EMEN1
SCHEMBL28251143 0.68 SLC6A2 (0.34) LMNAKMT2AALDH1A1MAPTKDM4E
SCHEMBL21689051 0.67 KDM4E (0.43) LMNATSHRKMT2AALDH1A1MAPT
SCHEMBL819237 0.67 TSHR (0.50) LMNATSHRKMT2AALDH1A1MAPT
SCHEMBL818859 0.66 KDM4E (0.39) LMNATSHRKMT2AALDH1A1MAPT
SCHEMBL6219590 0.65 TSHR (0.35) LMNATSHRKMT2AALDH1A1MAPT
SCHEMBL1126884 0.64 KMT2A (0.44) LMNATSHRKMT2AALDH1A1MAPT

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
WO-2007051062-A2 SUBSTITUTED DIHYDROPYRIDINES AND METHODS OF USE CHEMOCENTRYX, INC. (US) 2007-05-03 WO disclosed