SCHEMBL24975432

SCHEMBL24975432

FC(F)(F)c1ncc(OCc2ccccc2)c(Cl)n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIN1 Q13526 2/20 0.40
PLAU P00749 1/20 0.39
LRRK2 Q5S007 3/20 0.39
MAPT P10636 1/20 0.39
MAPK1 P28482 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
RXRA P19793 1/20 0.39
RXRB P28702 1/20 0.39
RXRG P48443 1/20 0.39
LTA4H P09960 1/20 0.39
MAPK14 Q16539 1/20 0.39
STAT3 P40763 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HTR1A P08908 1/20 0.38
ADRA1D P25100 1/20 0.38
ADRA1A P35348 1/20 0.38
ADRA1B P35368 1/20 0.38
BRD4 O60885 1/20 0.38

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
SCHEMBL10763451 0.85 MAPT (0.42) PIN1PLAUMAPTMAPK1TDP1
SCHEMBL24975433 0.82 HTT (0.51) MAPTMAPK1TDP1L3MBTL1RXRA
SCHEMBL24975429 0.82 RXRA (0.45) LRRK2MAPTMAPK1TDP1L3MBTL1
SCHEMBL30337545 0.80 PIN1 (0.51) PIN1PLAUMAPTMAPK1TDP1
SCHEMBL17270074 0.80 PIN1 (0.51) PIN1PLAUMAPTMAPK1TDP1
SCHEMBL6639288 0.78 L3MBTL1 (0.51) PIN1PLAUMAPTMAPK1TDP1
SCHEMBL30839874 0.78 L3MBTL1 (0.51) PIN1PLAUMAPTMAPK1TDP1
SCHEMBL22851668 0.78 MRGPRX4 (0.43) PIN1LRRK2MAPTMAPK1TDP1
SCHEMBL13195026 0.77 LTA4H (0.49) PIN1LTA4HMAPK14
SCHEMBL25382124 0.77 DCPS (0.52) MAPTMAPK1TDP1L3MBTL1RXRA

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
WO-2023005894-A1 INHIBITOR COMPOUND FOR WNT PATHWAY 杭州阿诺生物医药科技有限公司 2023-02-02 WO disclosed