SCHEMBL18504243

SCHEMBL18504243

COC(=O)c1cccc(SC(F)F)c1COc1ccn(O)n1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.37
HSD17B10 Q99714 2/20 0.37
PSMD14 O00487 1/20 0.34
KMT2A Q03164 5/20 0.33
TDP1 Q9NUW8 3/20 0.33
MEN1 O00255 2/20 0.33
ALDH1A1 P00352 3/20 0.33
TSHR P16473 2/20 0.33
HPGD P15428 1/20 0.33
KDM4E B2RXH2 2/20 0.33
TP53 P04637 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PKLR P30613 1/20 0.32
NR1H4 Q96RI1 1/20 0.32
GBA1 P04062 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
GLA P06280 1/20 0.32
VDR P11473 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
SCHEMBL18504665 0.90 NPC1 (0.35) POLBKMT2AMEN1ALDH1A1KDM4E
SCHEMBL18504284 0.90 TSHR (0.36) POLBHSD17B10KMT2ATDP1MEN1
SCHEMBL18504623 0.88 NR1H4 (0.36) POLBKMT2AMEN1NR1H4
SCHEMBL18504919 0.88 ALDH1A1 (0.39) POLBHSD17B10KMT2ATDP1MEN1
SCHEMBL18504833 0.88 LIG1 (0.32) KMT2AMEN1NR1H4
SCHEMBL18504448 0.88 NR1H4 (0.32) KMT2AMEN1NR1H4SMN1; SMN2
SCHEMBL18504991 0.87 NR1H4 (0.33) KMT2AMEN1NR1H4
SCHEMBL18504560 0.87 MEN1 (0.32) KMT2AMEN1NR1H4
SCHEMBL18504351 0.87 NR1H4 (0.33) KMT2AMEN1NR1H4
SCHEMBL18504402 0.87 TSHR (0.43) POLBHSD17B10PSMD14KMT2ATDP1

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
US-9565856-B2 Tetrazolinone compounds and its use as pesticides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-02-14 US disclosed