SCHEMBL5079340

SCHEMBL5079340

CC(CCC(C)OC(=O)C=Cc1ccccc1)OC(=O)C=Cc1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.60
MEN1 O00255 1/20 0.60
LMNA P02545 3/20 0.53
AKR1B10 O60218 2/20 0.53
AKR1B1 P15121 2/20 0.53
CA12 O43570 1/20 0.53
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
CA7 P43166 1/20 0.53
CA9 Q16790 1/20 0.53
CA14 Q9ULX7 1/20 0.53
ALDH1A1 P00352 3/20 0.52
TDP1 Q9NUW8 2/20 0.50
GLA P06280 1/20 0.50
MMP1 P03956 1/20 0.49
CYP1A2 P05177 2/20 0.48
CYP2C9 P11712 2/20 0.48
HDAC3 O15379 1/20 0.48
TNKS O95271 1/20 0.48
HDAC4 P56524 1/20 0.48

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
SCHEMBL5079339 1.00 KMT2A (0.60) KMT2AMEN1LMNAAKR1B10AKR1B1
SCHEMBL30249969 0.90 KMT2A (0.60) KMT2AMEN1LMNAAKR1B10AKR1B1
SCHEMBL18086797 0.90 KMT2A (0.54) KMT2AMEN1LMNAAKR1B10AKR1B1
SCHEMBL13725960 0.90 ALDH1A1 (0.60) KMT2AMEN1LMNAAKR1B10AKR1B1
SCHEMBL13725959 0.90 ALDH1A1 (0.60) KMT2AMEN1LMNAAKR1B10AKR1B1
Sec-Butyl Cinnamate SCHEMBL13347964 0.89 KMT2A (0.59) KMT2AMEN1LMNAAKR1B10AKR1B1
Sec-Butyl Cinnamate SCHEMBL13688230 0.89 KMT2A (0.59) KMT2AMEN1LMNAAKR1B10AKR1B1
Sec-Butyl Cinnamate SCHEMBL7530104 0.89 KMT2A (0.59) KMT2AMEN1LMNAAKR1B10AKR1B1
SCHEMBL12083364 0.89 KMT2A (0.59) KMT2AMEN1LMNAAKR1B10AKR1B1
SCHEMBL29160593 0.88 ALDH1A1 (0.54) KMT2AMEN1LMNAAKR1B10AKR1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1666505-B1 CATALYST COMPONENTS CATALYSTS FOR OLEFINIC POLYMERIZATION AND THE USE THEREOF CHINA PETROLEUM & CHEMICAL (CN) 2016-03-23 EP disclosed
US-7332455-B2 Catalyst component and catalyst for olefin polymerization as well as use thereof CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2008-02-19 US disclosed
EP-1666505-A1 CATALYST COMPONENTS CATALYSTS FOR OLEFINIC POLYMERIZATION AND THE USE THEREOF China Petroleum & Chemical Corporation (CN) 2006-06-07 EP disclosed
US-20050119427-A1 Catalyst component and catalyst for olefin polymerization as well as use thereof BEIJING RESEARCH INSTITUTE OF CHEMICAL INDUSTRY, CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2005-06-02 US disclosed