SCHEMBL19980200

SCHEMBL19980200

Cc1nc(Cl)nn1-c1nc(C(F)(F)F)ccc1C(=O)Nc1nnnn1C

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.47
CYP2C9 P11712 2/20 0.38
CYP1A2 P05177 1/20 0.38
HPGD P15428 1/20 0.38
CYP2C19 P33261 1/20 0.38
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.35
ALDH1A1 P00352 1/20 0.34

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
SCHEMBL19980127 0.90 POLB (0.44) POLBCYP2C9CYP1A2HPGDCYP2C19
SCHEMBL19980134 0.89 POLB (0.43) POLBCYP2C9CYP1A2HPGDCYP2C19
SCHEMBL19979928 0.83 POLB (0.43) POLBCYP2C9CYP1A2HPGDCYP2C19
SCHEMBL19980129 0.83 POLB (0.47) POLBCYP2C9CYP1A2HPGDCYP2C19
SCHEMBL19980176 0.82 POLB (0.44) POLBCYP2C9CYP1A2HPGDCYP2C19
SCHEMBL15786318 0.81 POLB (0.57) POLBCYP2C9CYP1A2HPGDCYP2C19
SCHEMBL19980199 0.81 POLB (0.45) POLBCYP2C9CYP1A2HPGDCYP2C19
SCHEMBL19980215 0.80 POLB (0.44) POLBCYP2C9CYP1A2HPGDCYP2C19
SCHEMBL19980110 0.80 POLB (0.44) POLBCYP2C9CYP1A2HPGDCYP2C19
SCHEMBL147094 0.80 LMNA (0.55) POLBCYP2C9LMNAGAA

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