SCHEMBL7784902

SCHEMBL7784902

CCOCn1c(C(F)(F)F)cc(Sc2ccccc2)c1-c1ccc(Cl)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.34
MAPT P10636 1/20 0.34
XBP1 P17861 1/20 0.34
HTT P42858 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
DDR1 Q08345 2/20 0.34
LMNA P02545 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
AKR1B1 P15121 1/20 0.31
PTGDR2 Q9Y5Y4 1/20 0.31
NR1H2 P55055 2/20 0.31
NR1H3 Q13133 2/20 0.31
SLC6A4 P31645 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CYP19A1 P11511 1/20 0.31
SLC6A9 P48067 1/20 0.31
TP53 P04637 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31

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
SCHEMBL7778137 0.86 NR1H2 (0.31) NR1H2NR1H3TP53
SCHEMBL7782997 0.85 PDE7A (0.37) SMN1; SMN2MAPTNPSR1LMNATDP1
SCHEMBL7778342 0.78 PTGDR2 (0.33) SMN1; SMN2MAPTXBP1HTTNPSR1
SCHEMBL7782597 0.77 NPSR1 (0.42) HTTNPSR1LMNAPTGDR2MEN1
SCHEMBL7782854 0.77 PTGDR2 (0.32) SMN1; SMN2MAPTXBP1HTTNPSR1
Hydrochloric Acid SCHEMBL28752946 0.75 KDM4E (0.37) MAPTHTTLMNATDP1MEN1
SCHEMBL8664414 0.73 KDM4E (0.31) HTTTP53
SCHEMBL7786263 0.73 PTGS1 (0.39) SMN1; SMN2MAPTHTTNPSR1LMNA
SCHEMBL7782978 0.72 KDM4E (0.31) TP53
SCHEMBL7784793 0.72 KDM4E (0.44) MAPTNPSR1TDP1PTGDR2MEN1

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
EP-0801058-B1 Arylthio, -sulfinyl and -sulfonyl pyrrole insecticidal agents AMERICAN CYANAMID CO (US) 2001-10-10 EP disclosed