SCHEMBL6239500

SCHEMBL6239500

COP(=O)(OC)C(c1ccc(F)cc1)c1ccc(F)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.40
HSD17B10 Q99714 1/20 0.39
IDO1 P14902 2/20 0.39
TDO2 P48775 2/20 0.39
ALDH1A1 P00352 3/20 0.38
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
LMNA P02545 2/20 0.38
ACP3 P15309 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
GAA P10253 2/20 0.37
AOC3 Q16853 1/20 0.37
KDM4E B2RXH2 1/20 0.36
FDPS P14324 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35

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
SCHEMBL6235926 0.79 ALOX15 (0.61) ALOX15IDO1TDO2MAPTLMNA
SCHEMBL5750561 0.78 ACP3 (0.53) ALDH1A1LMNAACP3MEN1KMT2A
SCHEMBL777805 0.71 ACP3 (0.57) IDO1TDO2ACP3CA12HDAC3
SCHEMBL6661073 0.70 KDM4E (0.49) HSD17B10ALDH1A1LMNAACP3MEN1
SCHEMBL6239506 0.68 ALDH1A1 (0.52) ALOX15ALDH1A1LMNAMEN1KMT2A
SCHEMBL17923949 0.67 UTRN (0.39) ALDH1A1KDM4ECA12CA1CA2
SCHEMBL6206390 0.67 AOC3 (0.44) IDO1TDO2ALDH1A1MAPTHTT
SCHEMBL781248 0.67 UTRN (0.48) ALDH1A1SMN1; SMN2GAAKDM4E
SCHEMBL6205426 0.66 AOC3 (0.47) IDO1TDO2ALDH1A1MAPTHTT
SCHEMBL792136 0.66 IDO1 (0.58) IDO1TDO2AOC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005003143-A1 NOVEL POTASSIUM CHANNEL MODULATORS POSEIDON PHARMACEUTICALS A/S (DK) 2005-01-13 WO claimed
WO-2005003143-A1 NOVEL POTASSIUM CHANNEL MODULATORS POSEIDON PHARMACEUTICALS A/S (DK) 2005-01-13 WO disclosed