SCHEMBL9836744

SCHEMBL9836744

C=C(C)C(OC(=O)Nc1cc(OC(C)C)c(Cl)cc1Cl)C(=O)OCC(C)C

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.44
MAPK1 P28482 1/20 0.44
LMNA P02545 5/20 0.39
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
MAPT P10636 4/20 0.39
NPSR1 Q6W5P4 3/20 0.39
TSHR P16473 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
RORC P51449 1/20 0.39
HPGD P15428 2/20 0.34
ALDH1A1 P00352 2/20 0.34
KDM4E B2RXH2 2/20 0.34
CYP2C9 P11712 2/20 0.34
CYP2C19 P33261 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
GPR35 Q9HC97 1/20 0.32
HTT P42858 1/20 0.32

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
SCHEMBL9836348 0.91 RORC (0.37) GAAMAPK1LMNAMEN1KMT2A
SCHEMBL27310660 0.88 GAA (0.44) GAAMAPK1LMNAMEN1KMT2A
SCHEMBL9837121 0.85 GAA (0.46) GAAMAPK1LMNAMEN1KMT2A
SCHEMBL9837090 0.84 SMN1; SMN2 (0.46) MAPK1LMNAMEN1KMT2AMAPT
SCHEMBL9836050 0.84 L3MBTL1 (0.41) LMNAMAPTNPSR1TSHRL3MBTL1
SCHEMBL9835551 0.80 DHODH (0.38) GAAMAPK1LMNAMEN1KMT2A
SCHEMBL9835444 0.80 RORC (0.39) GAAMAPK1LMNAMEN1KMT2A
SCHEMBL9836716 0.79 RORC (0.41) GAAMAPK1LMNAMEN1KMT2A
SCHEMBL9837587 0.78 LMNA (0.47) GAALMNAMEN1KMT2AMAPT
SCHEMBL27519213 0.78 LMNA (0.37) GAAMAPK1LMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0241559-B1 OXAZOLIDINEDIONE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND HERBICIDES CONTAINING THE SAME SAGAMI CHEMICAL RESEARCH CENTER (JP) 1991-10-30 EP disclosed
US-4983751-A Chemical intermediates SAGAMI CHEMICAL RESEARCH CENTER (JP) 1991-01-08 US disclosed
US-4818272-A NONPHYTOTOXICITY FOR CROPS HELICAL STREAMS SAGAMI CHEMICAL RESEARCH CENTER (JP) 1989-04-04 US disclosed
EP-0241559-A1 OXAZOLIDINEDIONE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND HERBICIDES CONTAINING THE SAME SAGAMI CHEMICAL RESEARCH CENTER (JP) 1987-10-21 EP disclosed