SCHEMBL18504967

SCHEMBL18504967

CCCOC(=O)c1cccc(Cl)c1COc1ccn(O)n1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
L3MBTL1 Q9Y468 3/20 0.41
KMT2A Q03164 1/20 0.41
ATM Q13315 1/20 0.41
TDP1 Q9NUW8 3/20 0.39
TSHR P16473 3/20 0.36
ALOX12 P18054 1/20 0.36
NR1H4 Q96RI1 2/20 0.36
TP53 P04637 1/20 0.36
CYP3A4 P08684 1/20 0.36
MAPK1 P28482 1/20 0.36
LMNA P02545 1/20 0.35
DHODH Q02127 2/20 0.35
CASP3 P42574 1/20 0.35
SENP8 Q96LD8 1/20 0.35
SENP7 Q9BQF6 1/20 0.35
SENP6 Q9GZR1 1/20 0.35
JMJD6 Q6NYC1 1/20 0.35

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
SCHEMBL18503104 0.91 ALDH1A1 (0.44) ALDH1A1L3MBTL1KMT2AATMTDP1
SCHEMBL22563998 0.88 ALDH1A1 (0.43) ALDH1A1L3MBTL1KMT2AATMTDP1
SCHEMBL18504288 0.88 ALDH1A1 (0.45) ALDH1A1L3MBTL1TDP1TSHRTP53
SCHEMBL18504667 0.88 ALDH1A1 (0.45) ALDH1A1L3MBTL1TDP1TSHRTP53
SCHEMBL18504404 0.87 ALDH1A1 (0.44) ALDH1A1L3MBTL1KMT2ATDP1TSHR
SCHEMBL18504290 0.87 ALDH1A1 (0.44) ALDH1A1L3MBTL1TDP1TSHRTP53
SCHEMBL18504421 0.87 ALDH1A1 (0.44) ALDH1A1L3MBTL1KMT2AATMTDP1
SCHEMBL18504289 0.87 ALDH1A1 (0.44) ALDH1A1L3MBTL1TDP1TSHRTP53
SCHEMBL18504649 0.86 TDP1 (0.41) ALDH1A1KMT2ATDP1NR1H4TP53
SCHEMBL18504259 0.86 ALDH1A1 (0.41) ALDH1A1L3MBTL1KMT2AATMTDP1

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