SCHEMBL28525554

SCHEMBL28525554

c1cnc(Oc2cccnc2)nc1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.61
TDP1 Q9NUW8 1/20 0.61
CYP11B1 P15538 1/20 0.51
CYP11B2 P19099 1/20 0.51
CYP19A1 P11511 3/20 0.50
MEN1 O00255 1/20 0.50
APAF1 O14727 1/20 0.50
KMT2A Q03164 1/20 0.50
ALDH1A1 P00352 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
CHRNB2 P17787 3/20 0.47
CHRNA4 P43681 3/20 0.47
LTA4H P09960 3/20 0.46
HTT P42858 1/20 0.46
KDM4E B2RXH2 1/20 0.46
HPGDS O60760 1/20 0.45
MAP4K4 O95819 1/20 0.45
CYP2A6 P11509 1/20 0.43

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
SCHEMBL20176880 0.84 LMNA (0.53) LMNATDP1CYP11B1CYP11B2CYP19A1
SCHEMBL3979969 0.84 LMNA (0.53) LMNATDP1CYP11B1CYP11B2CYP19A1
SCHEMBL30535283 0.84 LMNA (0.82) LMNATDP1CYP11B1CYP11B2CYP19A1
SCHEMBL676142 0.84 LMNA (0.82) LMNATDP1CYP11B1CYP11B2CYP19A1
Potassium SCHEMBL6776357 0.81 LMNA (0.78) LMNATDP1CYP11B1CYP11B2CYP19A1
SCHEMBL14820292 0.80 LMNA (0.49) LMNATDP1CYP11B1CYP11B2CYP19A1
SCHEMBL16114401 0.79 LMNA (0.75) LMNATDP1CYP11B1CYP11B2CYP19A1
SCHEMBL11610555 0.78 LMNA (0.55) LMNATDP1CYP11B1CYP11B2CYP19A1
SCHEMBL29782927 0.78 LMNA (0.55) LMNATDP1CYP11B1CYP11B2CYP19A1
SCHEMBL22061921 0.77 LMNA (0.87) LMNATDP1CYP11B1CYP11B2CYP19A1

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
CN-112384507-A Substituted 4-heteroaryloxypyridines and their salts and their use as herbicides 拜耳公司 2021-02-19 CN disclosed