SCHEMBL19299835

SCHEMBL19299835

CCS(=O)(=O)c1c(-c2nc3cc(C(F)(F)C(F)(F)F)nnc3n2C)sc2ccccc12

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.32
▸ ACSS2 Q9NR19 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ GFER P55789 1/20 0.32
▸ APOBEC3G Q9HC16 1/20 0.32
▸ TP53 P04637 1/20 0.31

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
SCHEMBL19299805 0.93 LMNA (0.33) LMNAACSS2KDM4EALDH1A1MAPT
SCHEMBL19299812 0.83 PTGS2 (0.35) LMNAKDM4EALDH1A1MAPTHPGD
SCHEMBL18072957 0.80 POLB (0.41) LMNAKDM4EALDH1A1MAPTHPGD
SCHEMBL19299809 0.79 RORC (0.34) LMNAACSS2KDM4EALDH1A1MAPT
SCHEMBL21948999 0.78 — —
SCHEMBL25106851 0.75 TRPM8 (0.32) —
SCHEMBL25106842 0.75 NR1H2 (0.32) —
SCHEMBL19985657 0.74 POLB (0.39) KDM4EALDH1A1HPGD
SCHEMBL20549754 0.73 TP53 (0.34) LMNAKDM4EALDH1A1MAPTHPGD
SCHEMBL19299811 0.73 MAPT (0.35) MAPT

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-2017144341-A1 CONDENSED BICYCLIC HETEROCYCLE DERIVATIVES AS PEST CONTROL AGENTS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2017-08-31 — — WO disclosed
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