SCHEMBL24384181

SCHEMBL24384181

COc1ccc(C)cc1NCCCSOCC(F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.44
GAA P10253 3/20 0.44
LMNA P02545 3/20 0.44
TSHR P16473 3/20 0.44
MAPK1 P28482 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
ALDH1A1 P00352 5/20 0.41
POLB P06746 2/20 0.41
KDM4E B2RXH2 1/20 0.41
CRHBP P24387 1/20 0.41
CRHR2 Q13324 1/20 0.41
HTT P42858 1/20 0.38
CYP2C9 P11712 1/20 0.38
QPCT Q16769 1/20 0.36
L3MBTL4 Q8NA19 1/20 0.36
L3MBTL3 Q96JM7 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
KMT2A Q03164 2/20 0.35
CHRM2 P08172 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
SCHEMBL24384201 0.75 CYP1A2 (0.33) MAPTLMNAMAPK1TDP1L3MBTL1
SCHEMBL28033918 0.74 GAA (0.56) MAPTGAALMNATSHRMAPK1
SCHEMBL24384167 0.73 TDP1 (0.33) MAPTLMNATSHRMAPK1TDP1
SCHEMBL13433960 0.73 LMNA (0.55) MAPTGAALMNATSHRMAPK1
SCHEMBL9423574 0.72 GAA (0.60) MAPTGAALMNATSHRMAPK1
SCHEMBL7531918 0.71 MAPT (0.59) MAPTGAALMNATSHRMAPK1
SCHEMBL11822323 0.70 MAPT (0.58) MAPTGAALMNATSHRMAPK1
SCHEMBL21809393 0.68 ALDH1A1 (0.64) MAPTLMNATSHRMAPK1L3MBTL1
SCHEMBL4387302 0.67 MAPT (0.63) MAPTGAALMNATSHRMAPK1
SCHEMBL11314106 0.67 TSHR (0.51) MAPTGAALMNATSHRMAPK1

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-2022090284-A1 EUROPIUM(III) COMPLEXES AS PH SENSORS CISBIO BIOASSAYS (FR) 2022-05-05 WO disclosed
EP-3992182-A1 EUROPIUM(III) COMPLEXES AS PH SENSORS Cisbio Bioassays (FR) 2022-05-04 EP disclosed