SCHEMBL7108856

SCHEMBL7108856

CON=C(C(=O)OC)c1ccccc1CON=C(C)C1CC1(C)c1cccc(Cl)c1Cl

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 8/20 0.45
PTGS2 P35354 1/20 0.38
NR1H4 Q96RI1 1/20 0.33
LMNA P02545 1/20 0.32
MEN1 O00255 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
MAPT P10636 1/20 0.30
CYP2C9 P11712 1/20 0.30
ALOX12 P18054 1/20 0.30
CYP2C19 P33261 1/20 0.30
KMT2A Q03164 1/20 0.30
SLC6A3 Q01959 1/20 0.30
P2RX7 Q99572 1/20 0.30
ADAM17 P78536 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
SCHEMBL7705191 0.85 HIF1A (0.52) HIF1APTGS2LMNAMAPTP2RX7
SCHEMBL6156221 0.85 HIF1A (0.52) HIF1APTGS2LMNAMAPTP2RX7
SCHEMBL6155877 0.85 HIF1A (0.48) HIF1APTGS2LMNAMAPT
SCHEMBL6155881 0.85 HIF1A (0.48) HIF1APTGS2LMNAMAPT
SCHEMBL6155883 0.85 HIF1A (0.48) HIF1APTGS2LMNAMAPT
SCHEMBL6158790 0.82 HIF1A (0.44) HIF1A
SCHEMBL6155943 0.82 HIF1A (0.44) HIF1A
SCHEMBL6158168 0.78 HIF1A (0.48) HIF1APTGS2NR1H4LMNAADAM17
SCHEMBL6156945 0.78 HIF1A (0.48) HIF1APTGS2NR1H4LMNAADAM17
SCHEMBL6156508 0.78 HIF1A (0.48) HIF1APTGS2NR1H4LMNAADAM17

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1286955-A1 ARYL AND HETEROARYLCYCLOPROPYL OXIME ETHERS AND THEIR USE AS FUNGICIDES Dow AgroSciences LLC (US) 2003-03-05 EP disclosed
US-6348627-B1 CONTROLLING PHYTOPATHOGENIC FUNGI DOW AGROSCIENCES LLC 2002-02-19 US disclosed
WO-2001087826-A1 ARYL AND HETEROARYLCYCLOPROPYL OXIME ETHERS AND THEIR USE AS FUNGICIDES ROHM AND HAAS COMPANY (US) 2001-11-22 WO disclosed