SCHEMBL18504402

SCHEMBL18504402

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

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
POLB P06746 2/20 0.40
HSD17B10 Q99714 2/20 0.40
PSMD14 O00487 1/20 0.37
RAB9A P51151 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
GAA P10253 2/20 0.36
KMT2A Q03164 3/20 0.35
NPC1 O15118 1/20 0.35
ALDH1A1 P00352 3/20 0.35
LMNA P02545 2/20 0.35
KDM4E B2RXH2 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TP53 P04637 1/20 0.35
HPGD P15428 2/20 0.35
MAPK10 P53779 1/20 0.33

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
SCHEMBL18500715 0.89 HSD17B10 (0.41) TSHRL3MBTL1TDP1POLBHSD17B10
SCHEMBL18504653 0.89 ALDH1A1 (0.46) TSHRL3MBTL1TDP1POLBHSD17B10
SCHEMBL18500326 0.88 NR1H4 (0.36) TSHRL3MBTL1POLBRAB9ASMN1; SMN2
SCHEMBL18504957 0.88 POLB (0.40) TSHRL3MBTL1TDP1POLBHSD17B10
SCHEMBL18504969 0.88 NPC1 (0.34) L3MBTL1POLBRAB9ASMN1; SMN2KMT2A
SCHEMBL22564207 0.88 TSHR (0.42) TSHRL3MBTL1TDP1POLBHSD17B10
SCHEMBL18504862 0.88 TSHR (0.34) TSHRL3MBTL1TDP1HSD17B10RAB9A
SCHEMBL18504748 0.87 NPC1 (0.33) TSHRL3MBTL1TDP1HSD17B10RAB9A
SCHEMBL18504782 0.87 TSHR (0.32) TSHRL3MBTL1TDP1HSD17B10RAB9A
SCHEMBL18504521 0.87 L3MBTL1 (0.32) TSHRL3MBTL1TDP1HSD17B10RAB9A

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