SCHEMBL9560746

SCHEMBL9560746

Fc1ccc(COCC(Cl)(c2ccc3c(c2)CCC3)C(F)(F)F)cc1Oc1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.37
KIF11 P52732 1/20 0.34
RXRB P28702 2/20 0.32
RXRA P19793 1/20 0.31
RXRG P48443 1/20 0.31
NPC1 O15118 2/20 0.30
RAB9A P51151 2/20 0.30
POLB P06746 1/20 0.30
GFER P55789 1/20 0.30
PAX8 Q06710 1/20 0.30
KLF5 Q13887 1/20 0.30
MRGPRX4 Q96LA9 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
TTR P02766 1/20 0.30

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
SCHEMBL9560881 0.86 MAPK14 (0.39) MAPK14KIF11RXRBRXRARXRG
SCHEMBL10837257 0.86 MAPK14 (0.39) MAPK14KIF11RXRBRXRARXRG
SCHEMBL10837214 0.85 MAPK14 (0.38) MAPK14KIF11RXRBRXRARXRG
SCHEMBL9561293 0.85 LMNA (0.35) MRGPRX4L3MBTL1MEN1KMT2ASMN1; SMN2
SCHEMBL9560787 0.85 L3MBTL1 (0.34) MRGPRX4L3MBTL1SMN1; SMN2TTR
SCHEMBL9560696 0.83 TACR1 (0.36) NPC1RAB9APOLBMRGPRX4KMT2A
SCHEMBL9560804 0.82 TTR (0.39) RAB9AL3MBTL1SMN1; SMN2TTR
SCHEMBL9560860 0.82 CHRM5 (0.36) MAPK14KIF11MRGPRX4TTR
SCHEMBL9560383 0.81 TTR (0.34) NPC1RAB9ATTR
SCHEMBL9560321 0.80 MAPT (0.40) KIF11L3MBTL1TTR

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
US-5225607-A Multistage etherification or dehydrohalogenation and reductive dechlorination IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-07-06 US disclosed
US-5196610-A INSECTICIDAL ETHERS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-03-23 US disclosed
EP-0211561-B1 INSECTICIDAL ETHERS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-03-11 EP disclosed
EP-0211561-A1 Insecticidal ethers IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-02-25 EP disclosed