SCHEMBL11263004

SCHEMBL11263004

[CH2]CCCCC(=O)/C(C)=C/COc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
ALPL P05186 1/20 0.41
ALPI P09923 1/20 0.41
ALPG P10696 1/20 0.41
KMT2A Q03164 1/20 0.41
HDAC1 Q13547 8/20 0.40
HDAC2 Q92769 8/20 0.40
HDAC3 O15379 6/20 0.40
HDAC4 P56524 6/20 0.40
HDAC7 Q8WUI4 6/20 0.40
HDAC10 Q969S8 6/20 0.40
HDAC11 Q96DB2 6/20 0.40
HDAC8 Q9BY41 6/20 0.40
HDAC6 Q9UBN7 6/20 0.40
HDAC9 Q9UKV0 6/20 0.40
HDAC5 Q9UQL6 6/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MTNR1A P48039 1/20 0.38
MTNR1B P49286 1/20 0.38
PPARD Q03181 1/20 0.38

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
SCHEMBL987061 0.78 ALOX15 (0.47) L3MBTL1MTNR1AMTNR1BPPARDPPARA
SCHEMBL11269344 0.78 ALOX15 (0.47) L3MBTL1MTNR1AMTNR1BPPARDPPARA
SCHEMBL28484371 0.74 MTNR1A (0.46) HDAC1HDAC2HDAC3HDAC4HDAC7
SCHEMBL9280575 0.72 KMT2A (0.56) MEN1ALPLALPIALPGKMT2A
SCHEMBL15292057 0.71 HDAC1 (0.56) HDAC1HDAC2HDAC3HDAC4HDAC7
SCHEMBL1135899 0.70 NDUFS8 (0.49) MEN1KMT2AMTNR1AMTNR1BALOX15
SCHEMBL8894295 0.70 THRB (0.55) MEN1KMT2AHDAC1HDAC2L3MBTL1
SCHEMBL10061377 0.69 L3MBTL1 (0.54) MEN1KMT2AHDAC1HDAC2HDAC3
SCHEMBL2868632 0.69 LSS (0.40) L3MBTL1MTNR1AALOX15
SCHEMBL2868634 0.69 LSS (0.40) L3MBTL1MTNR1AALOX15

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
US-4340765-A 4-Phenoxy-2-butene derivatives as plant growth regulators MALLINCKRODT BAKER, INC. 1982-07-20 US disclosed