SCHEMBL8664742

SCHEMBL8664742

CCSc1cc(Cl)nc(OCc2ccccc2)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIN1 Q13526 1/20 0.39
TSHR P16473 1/20 0.38
PRMT5 O14744 1/20 0.38
PIK3C3 Q8NEB9 1/20 0.38
MAPT P10636 1/20 0.37
HTT P42858 2/20 0.37
STAT3 P40763 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
KDM4E B2RXH2 2/20 0.36
HPGD P15428 1/20 0.36
ALOX5 P09917 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
KMT2A Q03164 1/20 0.36
BCHE P06276 1/20 0.36
ALDH1A1 P00352 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
GRM5 P41594 1/20 0.35
RXRA P19793 1/20 0.35
RXRB P28702 1/20 0.35
RXRG P48443 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
SCHEMBL8667748 0.86 PIN1 (0.40) PIN1TSHRPRMT5PIK3C3MAPT
SCHEMBL8670167 0.82 PIN1 (0.48) PIN1TSHRPRMT5PIK3C3HTT
SCHEMBL8665281 0.78 ALDH1A1 (0.49) PIN1TSHRPRMT5PIK3C3MAPT
SCHEMBL8384805 0.76 PIN1 (0.47) PIN1PRMT5PIK3C3ALOX5ALDH1A1
SCHEMBL8669771 0.75 ALDH1A1 (0.53) PIN1TSHRPRMT5PIK3C3HTT
SCHEMBL6639567 0.75 MPO (0.49) PIN1TSHRPRMT5PIK3C3MAPT
SCHEMBL8871531 0.74 ALOX5 (0.43) PIN1TSHRMAPTHTTSTAT3
SCHEMBL8667049 0.71 L3MBTL1 (0.41) MAPTKDM4EL3MBTL1ALDH1A1
SCHEMBL11009131 0.71 TSHR (0.52) PIN1TSHRMAPTHTTSTAT3
SCHEMBL8668293 0.70 MCL1 (0.39) PIN1TSHRPRMT5HTTHPGD

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-5723412-A HERBICIDES KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1998-03-03 US disclosed
US-5599770-A WEED CONTROL; INCLUDING AN ADJUVANT KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1997-02-04 US disclosed
EP-0694538-A2 2-benzyloxy-4-phenoxypyrimidine derivative, processes for producing the derivative and herbicidal composition containing the derivative KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1996-01-31 EP disclosed
EP-0692477-A1 Herbicidal compositions containing 2-benzyloxypyrimidine derivatives KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1996-01-17 EP disclosed