SCHEMBL8550502

SCHEMBL8550502

Cc1cc(Oc2cccc(C(F)(F)F)c2)nc(OCc2ccsc2)c1S

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
KDM4E B2RXH2 3/20 0.43
POLB P06746 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
NPSR1 Q6W5P4 2/20 0.40
MAPT P10636 2/20 0.40
LMNA P02545 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
MCOLN3 Q8TDD5 1/20 0.40
NTRK1 P04629 1/20 0.39
F10 P00742 1/20 0.37
PKM P14618 1/20 0.37
HSD17B10 Q99714 1/20 0.37
ESR1 P03372 1/20 0.36
PGR P06401 1/20 0.36
HTR1A P08908 1/20 0.36
DRD1 P21728 1/20 0.36
PTGS1 P23219 1/20 0.36
SLC6A2 P23975 1/20 0.36

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
SCHEMBL8546028 0.83 L3MBTL1 (0.45) ALDH1A1KDM4EPOLBL3MBTL1NPSR1
SCHEMBL8545000 0.81 L3MBTL1 (0.47) ALDH1A1KDM4EPOLBL3MBTL1NPSR1
SCHEMBL8773219 0.81 ALDH1A1 (0.55) ALDH1A1KDM4EPOLBL3MBTL1NPSR1
SCHEMBL8547073 0.80 L3MBTL1 (0.48) ALDH1A1KDM4EPOLBL3MBTL1NPSR1
SCHEMBL8546656 0.80 L3MBTL1 (0.45) ALDH1A1POLBL3MBTL1NPSR1MAPT
SCHEMBL8545730 0.79 L3MBTL1 (0.44) ALDH1A1KDM4EPOLBL3MBTL1NPSR1
SCHEMBL8550799 0.79 L3MBTL1 (0.45) ALDH1A1KDM4EPOLBL3MBTL1NPSR1
SCHEMBL8550496 0.78 L3MBTL1 (0.43) ALDH1A1KDM4EPOLBL3MBTL1NPSR1
SCHEMBL8550416 0.78 L3MBTL1 (0.43) ALDH1A1KDM4EPOLBL3MBTL1NPSR1
SCHEMBL8545122 0.77 POLB (0.43) ALDH1A1POLBL3MBTL1NPSR1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0693490-B1 2-Phenoxy-6-thienylmethyloxypyridine derivative, process for producing the same, and herbicidal composition KUREHA CHEMICAL IND CO LTD (JP) 1998-09-09 EP disclosed
US-5624942-A 2-phenoxy-6-thienylmethyloxypyridine derivative and herbicidal composition containing same KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1997-04-29 US disclosed
EP-0693490-A1 2-Phenoxy-6-thienylmethyloxypyridine derivative, process for producing the same, and herbicidal composition KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1996-01-24 EP disclosed