SCHEMBL9541469

SCHEMBL9541469

CC(C)=CCCOC([O])=O

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 4/20 0.50
ALDH1A1 P00352 3/20 0.44
KDM4E B2RXH2 1/20 0.39
ATM Q13315 1/20 0.39
POLB P06746 1/20 0.38
TSHR P16473 1/20 0.36
KMT2A Q03164 1/20 0.36
FNTA P49354 1/20 0.34
FNTB P49356 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
SCHEMBL3359346 0.83 ALOX15 (0.52) ALOX15ALDH1A1KDM4EATMPOLB
SCHEMBL4740513 0.83 ALOX15 (0.68) ALOX15ALDH1A1KDM4EATMPOLB
SCHEMBL3359350 0.81 ALOX15 (0.50) ALOX15ALDH1A1KDM4EATMPOLB
SCHEMBL16244314 0.79 ALOX15 (0.48) ALOX15ALDH1A1KDM4EATMPOLB
SCHEMBL6031146 0.79 ALOX15 (0.48) ALOX15ALDH1A1KDM4EATMPOLB
SCHEMBL13686652 0.76 BTN3A1 (0.49) ALOX15ALDH1A1KDM4EATMPOLB
SCHEMBL9544217 0.75
SCHEMBL16682272 0.73 ALOX15 (0.70) ALOX15ALDH1A1KDM4EATMKMT2A
SCHEMBL5077225 0.73 ALOX15 (0.59) ALOX15ALDH1A1KDM4EATMKMT2A
SCHEMBL15315224 0.73 ALOX15 (0.70) ALOX15ALDH1A1KDM4EATMKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1993011669-A1 USE OF 3-PHENYLURACIL DERIVATIVES FOR THE DESICCATION AND ABSCISSION OF PLANT PARTS BASF AKTIENGESELLSCHAFT (DE) 1993-06-24 WO disclosed