SCHEMBL2363137

SCHEMBL2363137

OCCOC1=CCCCC1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.34
RECQL P46063 1/20 0.34
NR1I2 O75469 1/20 0.32
LOX P28300 1/20 0.31
AOC3 Q16853 1/20 0.31
HDAC4 P56524 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31

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
SCHEMBL26601375 0.98 ALDH1A1 (0.33) ALDH1A1RECQLNR1I2LOXAOC3
SCHEMBL27335545 0.98 ALDH1A1 (0.33) ALDH1A1RECQLNR1I2LOXAOC3
SCHEMBL26124636 0.94
SCHEMBL16548117 0.89 MEN1 (0.39) ALDH1A1
SCHEMBL16548119 0.88 LOX (0.35) ALDH1A1LOXAOC3
SCHEMBL20280310 0.88 HRH3 (0.31) ALDH1A1
SCHEMBL16544487 0.85 KDM1A (0.30)
SCHEMBL27731693 0.82
SCHEMBL16544484 0.81
SCHEMBL546443 0.80 KCNH2 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101791577-B Chiral catalyst, and synthesis and application methods thereof YINGJIANG (TIANJIN) FRAGRANCE AND FLAVOR CO., LTD. (CN) 2011-11-30 CN claimed
CN-105777671-A Continuous process for epoxidizing olefins using supported heteropolyacids 长春人造树脂厂股份有限公司 2016-07-20 CN disclosed
CN-101791577-B Chiral catalyst, and synthesis and application methods thereof YINGJIANG (TIANJIN) FRAGRANCE AND FLAVOR CO., LTD. (CN) 2011-11-30 CN disclosed
CN-101791577-B Chiral catalyst, and synthesis and application methods thereof YINGJIANG (TIANJIN) FRAGRANCE AND FLAVOR CO., LTD. (CN) 2011-11-30 CN disclosed
EP-1270642-B1 BRANCHED POLYALKYLENE GLYCOLS KYOWA HAKKO KIRIN CO LTD (JP) 2011-08-31 EP disclosed
CN-101791577-A Chiral catalyst, and synthesis and application methods thereof YINGJIANG TIANJIN FRAGRANCE AND FLAVOR CO LTD 2010-08-04 CN disclosed
EP-1270642-A1 BRANCHED POLYALKYLENE GLYCOLS KYOWA HAKKO KOGYO CO., LTD. (JP) 2003-01-02 EP disclosed