SCHEMBL6557576

SCHEMBL6557576

CCOC(=O)c1cc(-n2c(=O)cc(C(F)(F)F)n(C)c2=O)ccc1OC(C)=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.42
LMNA P02545 2/20 0.42
CMA1 P23946 2/20 0.42
HPGD P15428 3/20 0.38
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 2/20 0.38
HSD17B10 Q99714 2/20 0.38
GAA P10253 1/20 0.38
PTGS1 P23219 1/20 0.38
PTGS2 P35354 1/20 0.38
MYC P01106 2/20 0.36
HTT P42858 3/20 0.36
MAPK1 P28482 1/20 0.35
RAB9A P51151 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
PKM P14618 1/20 0.35
NPC1 O15118 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35

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
SCHEMBL6559291 0.89 MAPT (0.39) MAPTLMNACMA1HPGDALDH1A1
SCHEMBL9571699 0.85 CA12 (0.46) MAPTLMNACMA1HPGDALDH1A1
SCHEMBL6699195 0.85 CYP4F2 (0.44) MAPTLMNACMA1ALDH1A1KDM4E
SCHEMBL6557384 0.80 BCAT1 (0.45) MAPTLMNAALDH1A1HSD17B10PTGS1
SCHEMBL7839984 0.78 CYP4F2 (0.33) MAPTLMNACMA1HPGDALDH1A1
SCHEMBL6908332 0.77 ALDH1A1 (0.39) HPGDALDH1A1KDM4EHSD17B10MYC
SCHEMBL6553785 0.75 CYP4F2 (0.34) MAPTLMNACMA1MAPK1KMT2A
SCHEMBL6553650 0.75 CYP4F2 (0.34) MAPTLMNACMA1HPGDALDH1A1
SCHEMBL9368363 0.75 CTSB (0.36) MAPTLMNACMA1HPGDHTT
SCHEMBL9423314 0.74 NOTUM (0.33) MAPTCMA1ALDH1A1GAAPTGS2

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-1021417-B1 SUBSTITUTED PHENYLURACILS BAYER CROPSCIENCE AG (DE) 2004-03-10 EP disclosed
US-6362337-B1 ACYLATING A HYDROXYPHENYLURACIL COMPOUND BAYER AKTIENGESELLSCHAFT (DE) 2002-03-26 US disclosed
US-6277789-B1 HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 2001-08-21 US disclosed