SCHEMBL5085822

SCHEMBL5085822

CCCC(OC(=O)/C=C/c1ccccc1)C(CC(C)C)C(=O)OCC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
ALDH1A1 P00352 1/20 0.42
LMNA P02545 3/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
KMT2A Q03164 4/20 0.41
MEN1 O00255 2/20 0.41
RAB9A P51151 3/20 0.40
EGFR P00533 1/20 0.40
MAPT P10636 2/20 0.40
NPC1 O15118 1/20 0.40
AKR1B10 O60218 1/20 0.40
AKR1B1 P15121 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.39

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
SCHEMBL5085824 1.00 MAOA (0.43) MAOAMAOBALDH1A1LMNACA12
SCHEMBL5086275 0.91 MAOA (0.44) MAOAMAOBALDH1A1LMNACA12
SCHEMBL5086271 0.91 MAOA (0.44) MAOAMAOBALDH1A1LMNACA12
SCHEMBL5082864 0.91 LMNA (0.45) MAOAMAOBALDH1A1LMNACA12
SCHEMBL5082868 0.91 LMNA (0.45) MAOAMAOBALDH1A1LMNACA12
SCHEMBL5083440 0.90 LMNA (0.44) MAOAMAOBALDH1A1LMNACA12
SCHEMBL5941399 0.90 KMT2A (0.43) MAOAMAOBALDH1A1LMNACA12
SCHEMBL5083444 0.90 LMNA (0.44) MAOAMAOBALDH1A1LMNACA12
SCHEMBL5941402 0.90 KMT2A (0.43) MAOAMAOBALDH1A1LMNACA12
SCHEMBL5085864 0.87 HDAC3 (0.43) MAOAMAOBALDH1A1LMNACA12

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
EP-1746110-B1 CATALYST COMPONENT FOR OLEFIN POLYMERIZATION REACTION AND CATALYST THEREOF CHINA PETROLEUM & CHEMICAL (CN) 2015-03-11 EP disclosed
US-7351778-B2 Catalyst component for olefin polymerization and catalyst comprising the same CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2008-04-01 US disclosed
EP-1746110-A1 CATALYST COMPONENT FOR OLEFIN POLYMERIZATION REACTION AND CATALYST THEREOF China Petroleum & Chemical Corporation (CN) 2007-01-24 EP disclosed