SCHEMBL29009446

SCHEMBL29009446

O=C(O)C(F)(F)Oc1ccc(Oc2ccc(C(F)(F)F)cn2)cc1

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.62
RAB9A P51151 1/20 0.62
MAPT P10636 2/20 0.60
NPSR1 Q6W5P4 2/20 0.60
LIPE Q05469 13/20 0.57
BCHE P06276 1/20 0.56
CYP3A4 P08684 1/20 0.53
GAA P10253 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
HTT P42858 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
THRB P10828 1/20 0.51

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
SCHEMBL11351938 0.83 MAPT (0.69) LMNARAB9AMAPTNPSR1LIPE
SCHEMBL20626652 0.83 LIPE (0.67) LMNARAB9AMAPTNPSR1LIPE
SCHEMBL4327207 0.83 LMNA (0.73) LMNARAB9AMAPTNPSR1LIPE
SCHEMBL10944778 0.81 LMNA (0.62) LMNARAB9AMAPTNPSR1LIPE
SCHEMBL23519004 0.80 TRPV1 (0.50)
SCHEMBL13020204 0.80 LMNA (0.60) LMNARAB9AMAPTNPSR1LIPE
SCHEMBL5174065 0.80 LMNA (0.58) LMNARAB9AMAPTNPSR1LIPE
SCHEMBL988337 0.80 LMNA (0.58) LMNARAB9AMAPTNPSR1LIPE
SCHEMBL8413343 0.80 SMN1; SMN2 (0.62) LMNARAB9AMAPTNPSR1LIPE
SCHEMBL8576331 0.79 MAPT (0.65) LMNARAB9AMAPTNPSR1LIPE

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
CN-116217470-A Aryloxy-phenoxy compound and application thereof as herbicide 沈阳中化农药化工研发有限公司 2023-06-06 CN disclosed