SCHEMBL7741770

SCHEMBL7741770

CCCOc1ccc(C(C=NOC(C)c2ccccc2C(=COC)C(=O)OC)=NOC)c(F)c1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KAT6A Q92794 1/20 0.33
HIF1A Q16665 3/20 0.32
FAAH O00519 2/20 0.32
LMNA P02545 1/20 0.31
CRBN Q96SW2 1/20 0.31
S1PR3 Q99500 1/20 0.30
PARP14 Q460N5 1/20 0.30
PARP10 Q53GL7 1/20 0.30
KDM4E B2RXH2 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL7501618 0.90 HIF1A (0.40) KAT6AHIF1AFAAHLMNACRBN
SCHEMBL7744909 0.86 SCN9A (0.30)
SCHEMBL7545134 0.85 KAT6A (0.34) KAT6AHIF1AFAAHLMNACRBN
SCHEMBL7736872 0.85 HIF1A (0.43) HIF1AL3MBTL1
SCHEMBL7502694 0.83 HIF1A (0.42) KAT6AHIF1ALMNAPARP14PARP10
SCHEMBL7494764 0.81 HIF1A (0.40) HIF1AFAAH
SCHEMBL8440483 0.80 KDM4E (0.32) HIF1AKDM4ESMN1; SMN2TDP1L3MBTL1
SCHEMBL7744876 0.79 MAPT (0.35) LMNAKDM4ESMN1; SMN2TDP1L3MBTL1
SCHEMBL7504420 0.79 HIF1A (0.38) HIF1ALMNA
SCHEMBL8538331 0.79 HIF1A (0.37) HIF1ALMNAL3MBTL1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6420423-B1 PESTICIDE FOR USE ON CEREALS, BEETS, FRUITS, BERRIES, AND BEANS; KILLS MITES, INSECTS, TERMITES, LICE, FLEAS, AND FUNGUS; TOLERATED WELL BE ANIMALS, PLANTS, AND FISH BAYER AKTIENGESELLSCHAFT (DE) 2002-07-16 US disclosed
US-5985921-A OXIDATION AND HYDROGENATION OF COMPOUNDS TO FORM INSECTICIDES AS AGROCHEMICALS NOVARTIS CORPORATION (US) 1999-11-16 US disclosed