SCHEMBL5597855

SCHEMBL5597855

CON=C(C(=O)OC(C)C(C)C)c1ccccc1CCl

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 8/20 0.45
KMT2A Q03164 1/20 0.32
ALDH1A1 P00352 3/20 0.31
TSHR P16473 1/20 0.31
HSP90AB1 P08238 1/20 0.31
LMNA P02545 2/20 0.31
POLB P06746 1/20 0.31
KDM4E B2RXH2 1/20 0.30
HPGD P15428 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL5597784 0.90 HIF1A (0.46) HIF1AKMT2AALDH1A1TSHRHSP90AB1
SCHEMBL5597653 0.86 HIF1A (0.44) HIF1AKMT2AALDH1A1
SCHEMBL29765456 0.84 HIF1A (0.60) HIF1AALDH1A1TSHRLMNAPOLB
SCHEMBL3311081 0.84 HIF1A (0.60) HIF1AALDH1A1TSHRLMNAPOLB
SCHEMBL3621124 0.84 HIF1A (0.60) HIF1AALDH1A1TSHRLMNAPOLB
SCHEMBL29765448 0.84 HIF1A (0.60) HIF1AALDH1A1TSHRLMNAPOLB
SCHEMBL5597636 0.82 ALDH1A1 (0.47) HIF1AKMT2AALDH1A1TSHRLMNA
SCHEMBL5597746 0.81 ALDH1A1 (0.36) KMT2AALDH1A1TSHRHSP90AB1LMNA
SCHEMBL3625146 0.80 HIF1A (0.47) HIF1AKMT2AALDH1A1TSHRLMNA
SCHEMBL3625149 0.80 HIF1A (0.47) HIF1AKMT2AALDH1A1TSHRLMNA

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-0765304-B2 METHOD OF PREPARING ALPHA-METHOXYIMINOCARBOXYLIC ACID METHYLAMIDES, AND INTERMEDIATES USED IN THE METHOD BAYER CROPSCIENCE AG (DE) 2007-08-22 EP claimed