SCHEMBL20511809

SCHEMBL20511809

COC1=NOC(NC(=O)O)C1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.32
TSHR P16473 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
MIF P14174 5/20 0.32
HTT P42858 2/20 0.32
CYP1A2 P05177 3/20 0.32
CYP2D6 P10635 3/20 0.32
HPGD P15428 1/20 0.31
CYP3A4 P08684 2/20 0.30
CYP2C19 P33261 2/20 0.30
CYP2C9 P11712 1/20 0.30
POLB P06746 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
SCHEMBL20511852 0.82 CA1 (0.36) TSHRKMT2AMIF
SCHEMBL18669141 0.81 GAA (0.41) CYP1A2CYP2D6CYP3A4CYP2C19CYP2C9
SCHEMBL20511864 0.77 CA1 (0.32) LMNA
SCHEMBL10086053 0.69 MIF (0.50) LMNATSHRMEN1KMT2ATDP1
SCHEMBL20508164 0.61 NFKB1 (0.43) LMNAMEN1KMT2AHPGDCYP3A4
SCHEMBL14354362 0.58
SCHEMBL9296414 0.57 NPSR1 (0.34) LMNATSHRKMT2AMIFHTT
SCHEMBL31295129 0.56 BRD4 (0.39) TSHRMEN1KMT2A
SCHEMBL25268709 0.55 BRD4 (0.34) LMNATSHR
SCHEMBL25274007 0.55 BRD4 (0.34) LMNATSHR

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-3601280-A1 INSECTICIDAL COMPOUNDS Syngenta Participations AG (CH) 2020-02-05 EP disclosed
WO-2018172480-A1 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2018-09-27 WO disclosed