SCHEMBL18504748

SCHEMBL18504748

CSc1cccc(C(=O)Cl)c1COc1ccn(O)n1

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NR1H4 Q96RI1 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
KMT2A Q03164 3/20 0.31
ALDH1A1 P00352 3/20 0.31
LMNA P02545 2/20 0.31
TSHR P16473 2/20 0.31
HTT P42858 2/20 0.31
MEN1 O00255 2/20 0.31
NPSR1 Q6W5P4 1/20 0.31
L3MBTL1 Q9Y468 3/20 0.31
HPGD P15428 2/20 0.30
HSD17B10 Q99714 1/20 0.30
GAA P10253 2/20 0.30
PKM P14618 1/20 0.30

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
SCHEMBL18500326 0.89 NR1H4 (0.36) NPC1RAB9ASMN1; SMN2NR1H4KMT2A
SCHEMBL18504712 0.89 HSD17B10 (0.36) SMN1; SMN2NR1H4TDP1KMT2AALDH1A1
SCHEMBL18504521 0.88 L3MBTL1 (0.32) NPC1RAB9ASMN1; SMN2NR1H4TDP1
SCHEMBL18504782 0.88 TSHR (0.32) NPC1RAB9ASMN1; SMN2NR1H4TDP1
SCHEMBL18504788 0.88 NPC1 (0.35) NPC1RAB9ASMN1; SMN2TDP1KMT2A
SCHEMBL22563921 0.87 NPC1 (0.32) NPC1RAB9ASMN1; SMN2NR1H4TDP1
SCHEMBL18504402 0.87 TSHR (0.43) NPC1RAB9ASMN1; SMN2TDP1KMT2A
SCHEMBL18504742 0.86
SCHEMBL18504862 0.86 TSHR (0.34) NPC1RAB9ASMN1; SMN2TDP1KMT2A
SCHEMBL18504351 0.85 NR1H4 (0.33) NR1H4KMT2AMEN1

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