SCHEMBL9743097

SCHEMBL9743097

COC=C(C(=O)OC)c1ccccc1CON=CCC(C)=O

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.38
MAPT P10636 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
MEN1 O00255 1/20 0.36
MAPK1 P28482 1/20 0.36
HIF1A Q16665 4/20 0.36
ALDH1A1 P00352 3/20 0.36
LMNA P02545 1/20 0.36
HPGD P15428 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
SCHEMBL9742771 0.82 HIF1A (0.45) HIF1ALMNA
SCHEMBL9742776 0.82 HIF1A (0.45) HIF1ALMNA
SCHEMBL18292032 0.82 HIF1A (0.39) HIF1AALDH1A1LMNA
SCHEMBL9743087 0.81 PTGS2 (0.39) HIF1AALDH1A1LMNAHPGD
SCHEMBL18292027 0.80 HIF1A (0.38) HIF1AALDH1A1LMNA
SCHEMBL18291973 0.80 HIF1A (0.42) HIF1A
SCHEMBL20822604 0.80 HIF1A (0.38) HIF1AALDH1A1LMNAHPGD
SCHEMBL8712575 0.78 HIF1A (0.39) KMT2AL3MBTL1HIF1AALDH1A1LMNA
SCHEMBL30367855 0.78 HIF1A (0.38) HIF1AALDH1A1
SCHEMBL9184121 0.77 IDO1 (0.41) HIF1AALDH1A1HPGD

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-5104872-A Agricultural or horticultural fungicides NIHON HOHYAKU CO., LTD. (JP) 1992-04-14 US disclosed
EP-0414153-A1 N-(substituted benzyloxy)imine derivatives, process for the production thereof, use thereof, and method of use thereof NIHON NOHYAKU CO., LTD. (JP) 1991-02-27 EP disclosed