SCHEMBL28038035

SCHEMBL28038035

CCCOC(C)(CCC(N)=O)c1ccccc1COc1ccccc1C

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 2/20 0.41
▸ FFAR1 O14842 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ RXRA P19793 1/20 0.38
▸ RXRB P28702 1/20 0.38
▸ RXRG P48443 1/20 0.38
▸ RECQL P46063 1/20 0.38
▸ PTGDR2 Q9Y5Y4 2/20 0.38
▸ ANXA2 P07355 1/20 0.38
▸ S100A10 P60903 1/20 0.38
▸ SLC1A5 Q15758 1/20 0.38
▸ TDP1 Q9NUW8 2/20 0.37
▸ CD274 Q9NZQ7 1/20 0.37
▸ MAPT P10636 1/20 0.36
▸ MAOB P27338 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.35
▸ CDK4 P11802 1/20 0.34
▸ CCND1 P24385 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
SCHEMBL28038046 0.91 ALDH1A1 (0.43) FFAR4FFAR1MEN1KMT2APTGDR2
SCHEMBL28038039 0.81 KMT2A (0.43) FFAR4FFAR1MEN1KMT2ARXRA
SCHEMBL28084209 0.81 KMT2A (0.41) FFAR4FFAR1MEN1KMT2ARXRA
SCHEMBL28038056 0.74 FFAR1 (0.43) FFAR4FFAR1MEN1KMT2ARXRA
SCHEMBL28084203 0.73 ALDH1A1 (0.43) FFAR4FFAR1MEN1KMT2APTGDR2
SCHEMBL28084226 0.72 CDK4 (0.46) FFAR4FFAR1MEN1KMT2ARXRA
SCHEMBL17328307 0.72 RXRA (0.49) FFAR4FFAR1MEN1KMT2ARXRA
SCHEMBL12894353 0.72 CDK4 (0.44) FFAR4FFAR1MEN1KMT2ARXRA
SCHEMBL28038050 0.72 PPARA (0.40) MEN1KMT2APTGDR2TDP1CD274
SCHEMBL8290730 0.70 MEN1 (0.57) MEN1KMT2ATDP1MAPT

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
CN-103641731-B The manufacture method of phenylacetyl amine compound SUMITOMO CHEMICAL CO., LTD. (JP) 2015-10-28 — — CN disclosed
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