SCHEMBL18504987

SCHEMBL18504987

O=C(Cl)c1cccc(F)c1COc1ccn(O)n1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
ALOX15 P16050 1/20 0.40
TDP1 Q9NUW8 2/20 0.39
KMT2A Q03164 3/20 0.35
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
SGMS2 Q8NHU3 1/20 0.35
ALKBH1 Q13686 2/20 0.34
GAA P10253 1/20 0.33
MEN1 O00255 2/20 0.32
MAPT P10636 1/20 0.32
PTGER1 P34995 1/20 0.32
NR1H4 Q96RI1 1/20 0.32
GUCY1B2 O75343 2/20 0.31
GUCY1A2 P33402 2/20 0.31
GUCY1A1 Q02108 2/20 0.31
GUCY1B1 Q02153 2/20 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
SCHEMBL18500953 0.89 ALKBH1 (0.40) ALDH1A1TDP1KMT2AATML3MBTL1
SCHEMBL18504774 0.88 KLKB1 (0.37) ALDH1A1TDP1KMT2AATML3MBTL1
SCHEMBL18504735 0.88 TDP1 (0.36) ALDH1A1TDP1KMT2AATML3MBTL1
SCHEMBL18504751 0.87 SGMS2 (0.37) ALDH1A1TDP1KMT2AATML3MBTL1
SCHEMBL22564082 0.86 ALDH1A1 (0.42) ALDH1A1ALOX15TDP1KMT2AATM
SCHEMBL18504704 0.86 NR1H4 (0.37) ALDH1A1TDP1KMT2AATML3MBTL1
SCHEMBL18504338 0.85 NR1H4 (0.31) NR1H4
SCHEMBL18504865 0.85 HDAC1 (0.36) TDP1KMT2ASGMS2ALKBH1MEN1
SCHEMBL18504744 0.85 SGMS2 (0.36) ALDH1A1TDP1KMT2ASGMS2ALKBH1
SCHEMBL18504220 0.85 KMT2A (0.40) ALDH1A1TDP1KMT2AATML3MBTL1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2841429-B1 TETRAZOLINONE COMPOUNDS AND ITS USE AS PESTICIDES SUMITOMO CHEMICAL CO (JP) 2020-10-21 EP disclosed
US-9565856-B2 Tetrazolinone compounds and its use as pesticides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-02-14 US disclosed