SCHEMBL7778342

SCHEMBL7778342

CCOCn1c(-c2ccc(Cl)cc2)c(Sc2ccccc2)c(Cl)c1C(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 2/20 0.33
AKR1B1 P15121 1/20 0.33
MAPT P10636 4/20 0.32
SMN1; SMN2 Q16637 4/20 0.32
HTT P42858 3/20 0.32
NPSR1 Q6W5P4 3/20 0.32
XBP1 P17861 1/20 0.32
TP53 P04637 2/20 0.31
MEN1 O00255 3/20 0.31
KMT2A Q03164 3/20 0.31
NR1H2 P55055 3/20 0.31
NR1H3 Q13133 3/20 0.31
CYP3A4 P08684 2/20 0.31
ALOX15 P16050 1/20 0.31
TSHR P16473 1/20 0.31
ALOX12 P18054 1/20 0.31
PPARG P37231 1/20 0.31
RECQL P46063 1/20 0.31
BLM P54132 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL7782854 0.89 PTGDR2 (0.32) PTGDR2AKR1B1MAPTSMN1; SMN2HTT
SCHEMBL7784740 0.79 PTGDR2 (0.36) PTGDR2AKR1B1MAPTSMN1; SMN2HTT
SCHEMBL7784902 0.78 SMN1; SMN2 (0.34) PTGDR2AKR1B1MAPTSMN1; SMN2HTT
SCHEMBL7784930 0.76
SCHEMBL8664041 0.76 MEN1 (0.32) MEN1KMT2A
SCHEMBL9220849 0.75 MAPK14 (0.33) MAPTNR1H2NR1H3CYP19A1
SCHEMBL5812558 0.75 RXFP1 (0.36) MAPTHTTNPSR1MEN1KMT2A
SCHEMBL8799002 0.72 MEN1 (0.34) MEN1KMT2ANR1H2NR1H3
SCHEMBL7778321 0.72 PTGDR2 (0.35) PTGDR2AKR1B1HTTMEN1KMT2A
SCHEMBL8986696 0.72 MEN1 (0.36) MAPTSMN1; SMN2XBP1MEN1KMT2A

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