SCHEMBL19979924

SCHEMBL19979924

Cn1nnnc1NC(=O)c1ccc(C(F)(F)F)nc1-n1cc(Cl)cn1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.47
ALDH1A1 P00352 2/20 0.36
CYP2C9 P11712 2/20 0.36
HPGD P15428 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
GAA P10253 1/20 0.35
PDE4A P27815 2/20 0.35
PDE4B Q07343 2/20 0.35
PDE4C Q08493 2/20 0.35
PDE4D Q08499 2/20 0.35
PDE11A Q9HCR9 1/20 0.35
LMNA P02545 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
SCN10A Q9Y5Y9 1/20 0.34
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL19979920 0.89 POLB (0.43) POLBCYP2C9HPGDCYP1A2CYP2C19
SCHEMBL19980107 0.89 POLB (0.43) POLBALDH1A1CYP2C9HPGDCYP1A2
SCHEMBL19979927 0.89 POLB (0.43) POLBALDH1A1CYP2C9HPGDCYP1A2
SCHEMBL19980216 0.87 POLB (0.41) POLBALDH1A1GAAPDE4APDE4B
SCHEMBL19980129 0.83 POLB (0.47) POLBALDH1A1CYP2C9HPGDCYP1A2
SCHEMBL19979963 0.82 POLB (0.47) POLBGAALMNASCN10A
SCHEMBL19980213 0.82 POLB (0.44) POLBALDH1A1CYP2C9HPGDCYP1A2
SCHEMBL19979902 0.82 POLB (0.46) POLBGAALMNASCN10A
SCHEMBL19979903 0.82 POLB (0.47) POLBCYP2C9HPGDCYP1A2CYP2C19
SCHEMBL15786318 0.81 POLB (0.57) POLBALDH1A1CYP2C9HPGDCYP1A2

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
WO-2018050677-A1 HERBICIDAL PYRIDINES SYNGENTA PARTICIPATIONS AG (CH) 2018-03-22 WO disclosed