SCHEMBL27499995

SCHEMBL27499995

C[C](C)c1ccc(CN)cc1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 6/20 0.56
F10 P00742 1/20 0.56
ABAT P80404 1/20 0.52
NOS3 P29474 2/20 0.52
NOS1 P29475 2/20 0.52
NOS2 P35228 2/20 0.52
HRH3 Q9Y5N1 1/20 0.50
HDAC3 O15379 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
NCOR2 Q9Y618 1/20 0.50
KDM4E B2RXH2 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
F11 P03951 1/20 0.44
TAAR1 Q96RJ0 1/20 0.42
PSIP1 O75475 1/20 0.41
ADRB2 P07550 1/20 0.41
ST14 Q9Y5Y6 2/20 0.41

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
SCHEMBL2399333 0.80 LOXL2 (0.52) LOXL2F10ABATNOS3NOS1
SCHEMBL4958605 0.80 TAAR1 (0.56) LOXL2NOS3NOS1NOS2KDM4E
SCHEMBL856509 0.80 KMT2A (0.67) LOXL2F10ABATNOS3NOS1
SCHEMBL24620530 0.80 LOXL2 (0.64) LOXL2F10ABATNOS3NOS1
SCHEMBL21697117 0.80 LOXL2 (0.52) LOXL2F10ABATNOS3NOS1
Methyl Alcohol SCHEMBL22528993 0.80 ABAT (0.67) LOXL2F10ABATNOS3NOS1
Hydrochloric Acid SCHEMBL7398643 0.78 KMT2A (0.64) LOXL2F10ABATNOS3NOS1
Hydrochloric Acid SCHEMBL6442361 0.78 LOXL2 (0.50) LOXL2F10ABATNOS3NOS1
SCHEMBL19941024 0.77 NOS1 (0.50) LOXL2F10ABATNOS3NOS1
Ethylene SCHEMBL11090983 0.77 KMT2A (0.61) LOXL2F10ABATNOS3NOS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105367611-A Olefin high-temperature polymerization metallocene catalyst and preparation method thereof and application of olefin high-temperature polymerization metallocene catalyst in olefin polymerization UNIV EAST CHINA SCIENCE & TECH 2016-03-02 CN claimed
CN-105367611-B A kind of olefin high-temperature polymerization metallocene catalyst and preparation method thereof and application in olefin polymerization 华东理工大学 2019-04-05 CN disclosed
CN-103958548-B Use the manufacture method of the olefin block polymers of multiple transition-metal catalyst SUMITOMO CHEMICAL CO.,LTD. (JP) 2016-05-18 CN disclosed
CN-105367611-A Olefin high-temperature polymerization metallocene catalyst and preparation method thereof and application of olefin high-temperature polymerization metallocene catalyst in olefin polymerization UNIV EAST CHINA SCIENCE & TECH 2016-03-02 CN disclosed
CN-1281584-C Process for producing dialkyl peroxide NIPPON OILS & FATS CO LTD (JP) 2006-10-25 CN disclosed
CN-1555362-A Process for producing dialkyl peroxide 日本油脂株式会社 2004-12-15 CN disclosed
CN-1268107-A Linear acetal and ketal pro-fragrances PROCTER & GAMBLE (US) 2000-09-27 CN disclosed
CN-1268127-A Pro-fragrance cyclic acetals PROCTER & GAMBLE (US) 2000-09-27 CN disclosed
CN-1233276-A Rinse added fabric softening composition and method for delivery of pro-fragrances PROCTER & GAMBLE (US) 1999-10-27 CN disclosed