SCHEMBL7941452

SCHEMBL7941452

CC(C)(C)c1cccc(CCC(=O)NCCCCO)c1O

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.45
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.42
HPGD P15428 1/20 0.42
ACKR3 P25106 1/20 0.41
IAPP P10997 3/20 0.39
CA2 P00918 1/20 0.39
MTNR1A P48039 1/20 0.38
MAOA P21397 1/20 0.38
ACHE P22303 1/20 0.38
MAOB P27338 1/20 0.38
KDM4E B2RXH2 1/20 0.38
LMNA P02545 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
SCHEMBL7933906 0.99 KMT2A (0.44) GAAKMT2AMEN1HPGDACKR3
SCHEMBL7933754 0.96 GAA (0.46) GAAKMT2AMEN1HPGDACKR3
SCHEMBL7944740 0.91 GAA (0.48) GAAKMT2AMEN1IAPPCA2
SCHEMBL8608450 0.88 KMT2A (0.45) GAAKMT2AMEN1HPGDACKR3
SCHEMBL8606484 0.85 GAA (0.47) GAAKMT2AMEN1ACKR3IAPP
SCHEMBL7941152 0.81 GAA (0.50) GAAKMT2AMEN1HPGDCA2
SCHEMBL7942495 0.81 GAA (0.50) GAAKMT2AMEN1HPGDMAOA
SCHEMBL7940002 0.81 GAA (0.49) GAAKMT2AMEN1CA2MAOA
SCHEMBL7942468 0.81 GAA (0.49) GAAKMT2AMEN1MAOAACHE
SCHEMBL6567369 0.79 CA2 (0.53) IAPPCA2

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
US-6242514-B1 CYCLIC PHOSPHATE OR PHOSPHONATE; HEAT AND OXIDATION STABILIZER ESPECIALLY FOR OLEFIN POLYMERS AND ENGINEERING THERMOPLASTICS SUMITOMO CHEMICAL COMPANY, LTD. (JP) 2001-06-05 US disclosed
US-6075159-A USE AS A STABILIZER FOR AN ORGANIC MATERIAL SUCH AS THERMOPLASTIC RESINS, THERMOSETTING RESINS, NATURAL OR SYNTHETIC RUBBERS, MINERAL OILS, LUBRICATING OILS, ADHESIVES AND PAINTS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-06-13 US disclosed
US-5914361-A IMPART HEAT STABILITY TO ORGANIC MATERIALS, INCLUDING POLYOLEFINS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-06-22 US disclosed