SCHEMBL18504889

SCHEMBL18504889

CCOc1cccc(-n2nnn(C)c2=O)c1I

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
RECQL P46063 2/20 0.40
MAPT P10636 2/20 0.40
LMNA P02545 1/20 0.40
POLB P06746 1/20 0.40
GAA P10253 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MAPK1 P28482 1/20 0.37
ALDH1A1 P00352 2/20 0.36
P2RX7 Q99572 1/20 0.36
CACNA2D1 P54289 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HTR1A P08908 1/20 0.35
ADRA1D P25100 1/20 0.35
ADRA1A P35348 1/20 0.35
ADRA1B P35368 1/20 0.35
HSD17B10 Q99714 1/20 0.35
DAO P14920 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
SCHEMBL18500482 0.89 KCNN4 (0.34) KDM4EMEN1KMT2ARECQLMAPT
SCHEMBL18504890 0.86 MGLL (0.37) KDM4EMEN1KMT2ARECQLMAPT
SCHEMBL15352670 0.84 KDM4E (0.43) KDM4EMEN1KMT2ARECQLMAPT
SCHEMBL15351858 0.82 KDM4E (0.39) KDM4EMEN1KMT2ARECQLMAPT
SCHEMBL18500709 0.82 BRPF1 (0.36) MEN1KMT2AMAPTP2RX7SMN1; SMN2
SCHEMBL18500951 0.81 MGLL (0.37) MEN1KMT2AMAPTLMNAHTR1A
SCHEMBL18503930 0.81 KCNN4 (0.36) P2RX7KCNN4
SCHEMBL18504511 0.81 HCAR1 (0.36) KDM4EP2RX7KCNN4
SCHEMBL18504531 0.79 MGLL (0.33) MEN1KMT2A
SCHEMBL16609550 0.79 MAPK1 (0.37) KDM4EMEN1KMT2ARECQLMAPT

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