SCHEMBL21021687

SCHEMBL21021687

CC(=O)C1C(c2cc(F)c(-n3nnc4ccccc43)c(F)c2)C1(Cl)Cl

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 7/20 0.40
MGAM O43451 6/20 0.40
AMY1A P0DUB6 6/20 0.40
SI P14410 6/20 0.40
MGAM2 Q2M2H8 6/20 0.40
KMT2A Q03164 4/20 0.38
MEN1 O00255 2/20 0.38
ALDH1A1 P00352 1/20 0.38
KCNMA1 Q12791 1/20 0.36
MAPT P10636 2/20 0.35
HPGD P15428 1/20 0.35
CCR6 P51684 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
F12 P00748 2/20 0.35
TNKS O95271 1/20 0.35
CYP2C9 P11712 1/20 0.35
CCNE1 P24864 1/20 0.35
CDK2 P24941 1/20 0.35
MAPK8 P45983 1/20 0.35
MAPK9 P45984 1/20 0.35

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
SCHEMBL21022047 0.78 KCNMA1 (0.38) GAAMGAMAMY1ASIMGAM2
SCHEMBL21021660 0.78 KCNMA1 (0.39) GAAMGAMAMY1ASIMGAM2
SCHEMBL21021811 0.72 TNKS (0.36) GAAMGAMAMY1ASIMGAM2
SCHEMBL12202056 0.66 GAA (0.47) GAAMGAMAMY1ASIMGAM2
SCHEMBL21021162 0.64 SLC9A1 (0.42) KMT2AMEN1ALDH1A1MAPTHPGD
SCHEMBL20676399 0.64 KCNMA1 (0.43) GAAMGAMAMY1ASIMGAM2
SCHEMBL26907875 0.64 KMT2A (0.41) GAAMGAMAMY1ASIMGAM2
SCHEMBL25022126 0.63 GAA (0.49) GAAMGAMAMY1ASIMGAM2
SCHEMBL20076620 0.63 SLC9A1 (0.40) KMT2AMEN1ALDH1A1MAPTSMN1; SMN2
SCHEMBL12204501 0.63 SLC9A1 (0.53) GAAMGAMAMY1ASIMGAM2

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
EP-3283459-B1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO DOW AGROSCIENCES LLC (US) 2019-05-22 EP disclosed