SCHEMBL19979874

SCHEMBL19979874

Cc1ncn(-c2nc(C(F)(F)F)ccc2C(=O)Nc2nnnn2C)n1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.43
GAA P10253 1/20 0.38
LMNA P02545 1/20 0.37
MALT1 Q9UDY8 4/20 0.36
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
HPGD P15428 1/20 0.34
CYP2C19 P33261 1/20 0.34
SCN10A Q9Y5Y9 3/20 0.34
PDE2A O00408 1/20 0.34
F9 P00740 1/20 0.34
MAP3K5 Q99683 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
SCHEMBL19979901 0.90 POLB (0.43) POLBGAALMNACYP1A2CYP2C9
SCHEMBL19979900 0.89 POLB (0.43) POLBGAALMNACYP1A2CYP2C9
SCHEMBL19980129 0.89 POLB (0.47) POLBGAALMNACYP1A2CYP2C9
SCHEMBL19980201 0.89 POLB (0.45) POLBGAALMNACYP1A2CYP2C9
SCHEMBL19980177 0.88 POLB (0.41) POLBGAALMNACYP1A2CYP2C9
SCHEMBL19980130 0.88 POLB (0.41) POLBGAALMNASCN10A
SCHEMBL19979899 0.87 POLB (0.41) POLBGAALMNAMALT1CYP1A2
SCHEMBL19980110 0.85 POLB (0.44) POLBGAALMNACYP1A2CYP2C9
SCHEMBL19980213 0.83 POLB (0.44) POLBGAALMNACYP1A2CYP2C9
SCHEMBL19980127 0.83 POLB (0.44) POLBGAALMNACYP1A2CYP2C9

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