SCHEMBL8106933

SCHEMBL8106933

CC1=C(c2ccccc2)C(=O)N(C(C)(C)C(=O)c2cccc(Cl)c2)CO1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 3/20 0.37
HSP90AB1 P08238 3/20 0.37
ADORA1 P30542 3/20 0.37
PGR P06401 1/20 0.36
MAPT P10636 3/20 0.36
USP2 O75604 1/20 0.35
ALDH1A1 P00352 3/20 0.35
LMNA P02545 1/20 0.35
PKM P14618 1/20 0.35
HPGD P15428 1/20 0.35
RAB9A P51151 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
SLC6A2 P23975 2/20 0.34
ERCC5 P28715 1/20 0.34
FEN1 P39748 1/20 0.34
CHRNA1 P02708 1/20 0.34
CHRNG P07510 1/20 0.34
ITGA5 P08648 1/20 0.34
CHRNB1 P11230 1/20 0.34
CHRNB2 P17787 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
SCHEMBL8111429 0.91 ACLY (0.32) ADORA1MAPT
SCHEMBL8111418 0.89 KMT2A (0.33) HSP90AA1HSP90AB1ADORA1MAPTALDH1A1
SCHEMBL8107286 0.88 MGLL (0.36) HSP90AA1HSP90AB1PGRMAPTALDH1A1
SCHEMBL8106922 0.85 LRRK2 (0.39) ALDH1A1LMNAHPGD
SCHEMBL8105496 0.85 HTR7 (0.33) PGRLMNAHPGD
SCHEMBL7995591 0.84 MAPT (0.43) MAPTALDH1A1LMNAPKMHPGD
SCHEMBL8783103 0.83 HSP90AA1 (0.39) HSP90AA1HSP90AB1ADORA1PGRMAPT
SCHEMBL8111262 0.82 PTGS1 (0.33) ADORA1MAPTPTGS1
SCHEMBL8107261 0.82 SHMT1 (0.40) MAPTALDH1A1LMNA
SCHEMBL8107525 0.81 PTGS1 (0.39) MAPTALDH1A1CYP2C19PTGS1PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6046135-A FOR CONTROLLING WEEDS RHONE-POULENC AGRICULTURE LTD (GB) 2000-04-04 US claimed
EP-0866788-A1 1,3-OXAZIN-4-ONE DERIVATIVES AS HERBICIDES RHONE-POULENC AGRICULTURE LTD. (GB) 1998-09-30 EP claimed
WO-1997021688-A1 1,3-OXAZIN-4-ONE DERIVATIVES AS HERBICIDES RHONE-POULENC AGRICULTURE LTD. (GB) 1997-06-19 WO claimed
US-6046135-A FOR CONTROLLING WEEDS RHONE-POULENC AGRICULTURE LTD (GB) 2000-04-04 US disclosed
EP-0866788-A1 1,3-OXAZIN-4-ONE DERIVATIVES AS HERBICIDES RHONE-POULENC AGRICULTURE LTD. (GB) 1998-09-30 EP disclosed
WO-1997021688-A1 1,3-OXAZIN-4-ONE DERIVATIVES AS HERBICIDES RHONE-POULENC AGRICULTURE LTD. (GB) 1997-06-19 WO disclosed