SCHEMBL28038052

SCHEMBL28038052

Cc1ccccc1OCc1ccccc1C(C)(C)OC(=O)CO

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 1/20 0.43
▸ FFAR4 Q5NUL3 1/20 0.43
▸ RXRA P19793 2/20 0.43
▸ RXRB P28702 2/20 0.43
▸ RXRG P48443 2/20 0.43
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ RECQL P46063 1/20 0.40
▸ PTGDR2 Q9Y5Y4 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ CDK4 P11802 1/20 0.39
▸ CCND1 P24385 1/20 0.39
▸ MAPT P10636 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ TDP1 Q9NUW8 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
SCHEMBL28038435 0.88 CYP2C9 (0.45) FFAR1FFAR4MEN1KMT2APTGDR2
SCHEMBL28038056 0.86 FFAR1 (0.43) FFAR1FFAR4RXRARXRBRXRG
SCHEMBL28084226 0.78 CDK4 (0.46) FFAR1FFAR4RXRARXRBRXRG
SCHEMBL17328307 0.77 RXRA (0.49) FFAR1FFAR4RXRARXRBRXRG
SCHEMBL12894353 0.77 CDK4 (0.44) FFAR1FFAR4RXRARXRBRXRG
SCHEMBL27940394 0.76 CYP2C9 (0.43) FFAR1FFAR4MEN1KMT2APTGDR2
SCHEMBL28038037 0.74 FFAR1 (0.39) FFAR1FFAR4RXRARXRBRXRG
SCHEMBL13154275 0.73 FFAR1 (0.57) FFAR1FFAR4RXRARXRBRXRG
SCHEMBL29787367 0.73 FFAR1 (0.44) FFAR1FFAR4RXRARXRBRXRG
SCHEMBL9025882 0.73 FFAR1 (0.44) FFAR1FFAR4RXRARXRBRXRG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103588657-B The manufacture method of phenylacetyl amines 住友化学株式会社 2016-06-22 — — CN disclosed
CN-103641731-B The manufacture method of phenylacetyl amine compound SUMITOMO CHEMICAL CO., LTD. (JP) 2015-10-28 — — CN disclosed
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