SCHEMBL9771604

SCHEMBL9771604

COc1ccc(C(OC(c2ccc(F)cc2)c2ccc(OC)cc2)c2ccc(F)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NFE2L2 Q16236 1/20 0.53
▸ IDO1 P14902 2/20 0.48
▸ TDO2 P48775 2/20 0.48
▸ LMNA P02545 3/20 0.47
▸ MITF O75030 2/20 0.47
▸ HTT P42858 2/20 0.47
▸ MAPK1 P28482 2/20 0.47
▸ CNR1 P21554 1/20 0.47
▸ CNR2 P34972 1/20 0.47
▸ GPR35 Q9HC97 1/20 0.47
▸ GPR55 Q9Y2T6 1/20 0.47
▸ XBP1 P17861 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ GAA P10253 2/20 0.46
▸ HPGD P15428 1/20 0.46
▸ CA12 O43570 1/20 0.46
▸ CA1 P00915 1/20 0.46
▸ CA2 P00918 1/20 0.46
▸ CA7 P43166 1/20 0.46
▸ CA9 Q16790 1/20 0.46

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
SCHEMBL3389444 0.89 CA1 (0.58) MAPK1NPSR1GAACA12CA1
SCHEMBL8298 0.82 — —
SCHEMBL7024215 0.82 — —
SCHEMBL9765970 0.81 ACHE (0.65) MAPK1HPGDCA12CA1CA2
SCHEMBL78901 0.81 ACP3 (0.56) MAPK1NPSR1CA12CA1CA2
SCHEMBL3752413 0.79 NFE2L2 (0.53) NFE2L2IDO1TDO2LMNAMITF
SCHEMBL13427765 0.79 NFE2L2 (0.53) NFE2L2LMNAMITFHTTMAPK1
SCHEMBL8440000 0.79 HPGD (0.50) IDO1TDO2MAPK1CNR2GAA
SCHEMBL9771565 0.79 KMT2A (0.54) IDO1TDO2LMNAMAOBALDH1A1
SCHEMBL13427773 0.78 GAA (0.50) NFE2L2LMNAMITFHTTMAPK1

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
US-4981835-A BENZYL ETHER DERIVATIVE FUJI PHOTO FILM CO., LTD. (JP) 1991-01-01 — — US disclosed
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