SCHEMBL6155358

SCHEMBL6155358

CC(=O)C1CC1c1c(F)cccc1F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.43
HTR2B P41595 1/20 0.43
GPR88 Q9GZN0 1/20 0.41
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
MAPK1 P28482 1/20 0.39
CES2 O00748 2/20 0.38
CES1 P23141 2/20 0.38
NOTUM Q6P988 1/20 0.36
KIF11 P52732 1/20 0.35
CHRNB2 P17787 1/20 0.35
CHRNA4 P43681 1/20 0.35
KDM1A O60341 2/20 0.35
ALDH1A1 P00352 1/20 0.34
ALOX15 P16050 1/20 0.34
BCHE P06276 1/20 0.34
TTR P02766 1/20 0.34
HTT P42858 1/20 0.34
HCRTR1 O43613 1/20 0.34
HCRTR2 O43614 1/20 0.34

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
SCHEMBL6155361 1.00 HTR2C (0.43) HTR2CHTR2BGPR88KMT2AMEN1
SCHEMBL1586523 0.89 MEN1 (0.52) GPR88KMT2AMEN1MAPK1ALDH1A1
SCHEMBL1586594 0.78 ALDH1A1 (0.41) HTR2CHTR2BKMT2AMEN1MAPK1
SCHEMBL6130264 0.78 ALDH1A1 (0.41) HTR2CHTR2BKMT2AMEN1MAPK1
SCHEMBL16586861 0.73 KDM1A (0.44) KMT2AKDM1AHCRTR1HCRTR2
SCHEMBL16586862 0.73 KDM1A (0.44) KMT2AKDM1AHCRTR1HCRTR2
SCHEMBL16585271 0.73 MEN1 (0.50) KMT2AMEN1MAPK1ALDH1A1
SCHEMBL17985242 0.73 MEN1 (0.50) KMT2AMEN1MAPK1ALDH1A1
SCHEMBL30636963 0.73 FFAR1 (0.47) TTR
SCHEMBL16585100 0.73 MEN1 (0.50) KMT2AMEN1MAPK1ALDH1A1

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