SCHEMBL6158818

SCHEMBL6158818

CC(=O)CCc1c(F)cccc1F

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.50
IAPP P10997 1/20 0.47
KDM4E B2RXH2 3/20 0.43
LMNA P02545 2/20 0.43
HPGD P15428 2/20 0.43
POLB P06746 1/20 0.43
TSHR P16473 1/20 0.43
CES2 O00748 2/20 0.41
CES1 P23141 2/20 0.41
FFAR1 O14842 1/20 0.41
FFAR4 Q5NUL3 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
DAO P14920 1/20 0.39
MEN1 O00255 1/20 0.38
THRB P10828 1/20 0.38
KMT2A Q03164 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
TAAR1 Q96RJ0 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
SCHEMBL1352 0.87 TAAR1 (0.58) ALDH1A1KDM4EHPGDNPC1RAB9A
SCHEMBL27558917 0.83 CES2 (0.44) ALDH1A1IAPPKDM4EPOLBCES2
SCHEMBL4714927 0.81 FFAR1 (0.59) ALDH1A1KDM4ECES2CES1FFAR1
SCHEMBL19438660 0.81 MPO (0.54) ALDH1A1KDM4ECES2CES1FFAR1
SCHEMBL24428791 0.81 ALDH1A1 (0.38) ALDH1A1IAPPKDM4ELMNAHPGD
SCHEMBL4717563 0.79 TAAR1 (0.42) ALDH1A1KDM4ECES2CES1FFAR1
SCHEMBL16070965 0.79 IAPP (0.56) ALDH1A1IAPPLMNACES2CES1
SCHEMBL8979538 0.79 TP53 (0.51) ALDH1A1HPGDPOLBNPC1RAB9A
SCHEMBL6303011 0.79 MPO (0.39) ALDH1A1KDM4ELMNAHPGDPOLB
SCHEMBL1461227 0.78 CES2 (0.44) ALDH1A1KDM4ECES2CES1NPC1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1286955-B1 ARYL AND HETEROARYLCYCLOPROPYL OXIME ETHERS AND THEIR USE AS FUNGICIDES DOW AGROSCIENCES LLC (US) 2005-02-02 EP disclosed
EP-1286955-A1 ARYL AND HETEROARYLCYCLOPROPYL OXIME ETHERS AND THEIR USE AS FUNGICIDES Dow AgroSciences LLC (US) 2003-03-05 EP disclosed
US-6348627-B1 CONTROLLING PHYTOPATHOGENIC FUNGI DOW AGROSCIENCES LLC 2002-02-19 US disclosed
WO-2001087826-A1 ARYL AND HETEROARYLCYCLOPROPYL OXIME ETHERS AND THEIR USE AS FUNGICIDES ROHM AND HAAS COMPANY (US) 2001-11-22 WO disclosed