SCHEMBL7995629

SCHEMBL7995629

C=NC(C)(C)C(=O)OCC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 3/20 0.41
CYP4A11 Q02928 3/20 0.41
ALDH1A1 P00352 3/20 0.40
PKM P14618 3/20 0.39
MMP8 P22894 2/20 0.39
LMNA P02545 1/20 0.39
HSD17B10 Q99714 1/20 0.39
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
THRB P10828 1/20 0.37
ALOX15 P16050 1/20 0.37
MGAM O43451 1/20 0.37
GAA P10253 1/20 0.37
SI P14410 1/20 0.37
MGAM2 Q2M2H8 1/20 0.37
SOAT1 P35610 1/20 0.37
ABCB11 O95342 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37

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
SCHEMBL530506 0.81 CYP4F2 (0.44) CYP4F2CYP4A11ALDH1A1PKMMMP8
SCHEMBL1713464 0.81 CYP4F2 (0.44) CYP4F2CYP4A11ALDH1A1PKMMMP8
SCHEMBL7995691 0.79 ALDH1A1 (0.47) ALDH1A1LMNACYP1A2TSHR
SCHEMBL19199679 0.77 MMP8 (0.43) CYP4F2CYP4A11ALDH1A1PKMMMP8
SCHEMBL3934442 0.74 ALDH1A1 (0.37) CYP4F2CYP4A11ALDH1A1PKMMMP8
SCHEMBL11725731 0.74 MGAM (0.39) CYP4F2CYP4A11ALDH1A1PKMMMP8
SCHEMBL3142260 0.74 PKM (0.41) CYP4F2CYP4A11ALDH1A1PKMMMP8
SCHEMBL3937564 0.74 MGAM (0.39) CYP4F2CYP4A11ALDH1A1PKMMMP8
SCHEMBL3142256 0.74 PKM (0.41) CYP4F2CYP4A11ALDH1A1PKMMMP8
SCHEMBL7839348 0.74 MEN1 (0.40) CYP4F2CYP4A11ALDH1A1PKMMMP8

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 8 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 disclosed
US-6028032-A FOR CONTROLLING WEEDS RHONE-POULENC AGRICULTURE LTD. (GB) 2000-02-22 US disclosed
EP-0900216-A1 1,3-OXAZIN-4-ONE DERIVATES AS HERBICIDES, PROCESS AND INTERMEDIATES FOR THEIR PREPARATION RHONE-POULENC AGRICULTURE LTD. (GB) 1999-03-10 EP disclosed
EP-0866788-A1 1,3-OXAZIN-4-ONE DERIVATIVES AS HERBICIDES RHONE-POULENC AGRICULTURE LTD. (GB) 1998-09-30 EP disclosed
EP-0833821-A1 1,3-OXAZIN-4-ONE DERIVATIVES AS HERBICIDES RHONE-POULENC AGRICULTURE LTD. (GB) 1998-04-08 EP disclosed
WO-1997040041-A1 1,3-OXAZIN-4-ONE DERIVATES AS HERBICIDES, PROCESS AND INTERMEDIATES FOR THEIR PREPARATION RHONE-POULENC AGRICULTURE LTD. (GB) 1997-10-30 WO disclosed
WO-1997021688-A1 1,3-OXAZIN-4-ONE DERIVATIVES AS HERBICIDES RHONE-POULENC AGRICULTURE LTD. (GB) 1997-06-19 WO disclosed
WO-1997000865-A1 1,3-OXAZIN-4-ONE DERIVATIVES AS HERBICIDES RHONE-POULENC AGRICULTURE LTD. (GB) 1997-01-09 WO disclosed