SCHEMBL8072579

SCHEMBL8072579

CCCCOc1ccccc1OC(=O)CC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
KMT2A Q03164 3/20 0.50
LMNA P02545 3/20 0.50
MEN1 O00255 2/20 0.50
MAPT P10636 2/20 0.50
KDM4E B2RXH2 1/20 0.50
RECQL P46063 1/20 0.50
NR1I2 O75469 1/20 0.50
CHRM2 P08172 1/20 0.50
CYP3A4 P08684 1/20 0.50
ADRA2A P08913 1/20 0.50
OPRK1 P41145 1/20 0.50
HTR2B P41595 1/20 0.50
SLC6A3 Q01959 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
AKR1C3 P42330 1/20 0.46
ELANE P08246 1/20 0.46
TSHR P16473 2/20 0.46

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
SCHEMBL8081153 0.95 LMNA (0.56) CYP1A2CYP2C9CYP2C19KMT2ALMNA
SCHEMBL8081134 0.93 LMNA (0.59) KMT2ALMNAMEN1MAPTKDM4E
SCHEMBL8084776 0.93 LMNA (0.59) KMT2ALMNAMEN1MAPTKDM4E
SCHEMBL8084797 0.91 NPC1 (0.47) KMT2ALMNAMEN1MAPTKDM4E
SCHEMBL18076008 0.87 CYP1A2 (0.49) CYP1A2CYP2C9CYP2C19KMT2ALMNA
SCHEMBL11685011 0.86 KDM4E (0.44) KMT2ALMNAMAPTKDM4ERECQL
SCHEMBL6575493 0.86 CYP1A2 (0.55) CYP1A2CYP2C9CYP2C19KMT2ALMNA
SCHEMBL15548129 0.85 CYP1A2 (0.44) CYP1A2CYP2C9CYP2C19KMT2ALMNA
SCHEMBL8435546 0.85 ALOX15 (0.55) KMT2AMEN1MAPTKDM4ERECQL
SCHEMBL26698283 0.85 LMNA (0.46) LMNAMAPTKDM4EELANETSHR

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
CN-109096420-B Catalyst for olefin polymerization and olefin polymerization method 中国石油化工股份有限公司 2021-05-11 CN disclosed
EP-0758013-B1 Liquid crystalline optical film, compensating film for liquid crystal display and liquid crystal display NIPPON OIL CO LTD (JP) 2000-10-11 EP disclosed
US-5855971-A Liquid crystalline optical film, compensating film for liquid crystal display comprising the liquid crystalline optical film, and liquid crystal display having the compensating film NIPPON OIL COMPANY, LIMITED (JP) 1999-01-05 US disclosed
EP-0758013-A1 Liquid crystalline optical film, compensating film for liquid crystal display and liquid crystal display NIPPON OIL COMPANY, LIMITED (JP) 1997-02-12 EP disclosed