SCHEMBL5576771

SCHEMBL5576771

CC(=O)COC/C=C(\C)CCC=C(C)C

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.62
ALDH1A1 P00352 1/20 0.62
FNTA P49354 7/20 0.54
FNTB P49356 5/20 0.54
KMT2A Q03164 2/20 0.52
KDM4E B2RXH2 1/20 0.48
ATM Q13315 1/20 0.48
MEN1 O00255 1/20 0.48
CYP3A4 P08684 1/20 0.48
PGGT1B P53609 3/20 0.48
TRPV1 Q8NER1 1/20 0.48
POLB P06746 1/20 0.47

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
SCHEMBL6579163 0.87 ALOX15 (0.61) ALOX15ALDH1A1FNTAFNTBKMT2A
SCHEMBL6579169 0.87 ALOX15 (0.61) ALOX15ALDH1A1FNTAFNTBKMT2A
SCHEMBL9305768 0.86 FNTA (0.59) ALOX15ALDH1A1FNTAFNTBKMT2A
SCHEMBL9305765 0.86 FNTA (0.59) ALOX15ALDH1A1FNTAFNTBKMT2A
SCHEMBL3664267 0.84 ALDH1A1 (0.67) ALOX15ALDH1A1FNTAFNTBPGGT1B
SCHEMBL27649625 0.84 KMT2A (0.65) ALOX15ALDH1A1FNTAFNTBKMT2A
SCHEMBL492962 0.84 KMT2A (0.65) ALOX15ALDH1A1FNTAFNTBKMT2A
SCHEMBL3400313 0.84 KMT2A (0.65) ALOX15ALDH1A1FNTAFNTBKMT2A
SCHEMBL28854298 0.84 KMT2A (0.65) ALOX15ALDH1A1FNTAFNTBKMT2A
SCHEMBL492960 0.84 KMT2A (0.65) ALOX15ALDH1A1FNTAFNTBKMT2A

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-108250055-B Preparation method of pyruvylgeranyl pyrophosphate intermediate 重庆医药工业研究院有限责任公司 2022-08-05 CN disclosed
CN-106661498-B Isomeric mixtures of musk compounds having an unsaturated macrocyclic ring 西姆莱斯有限公司 2021-11-23 CN disclosed
CN-106535866-B E isomer-enriched mixtures of musk compounds having an unsaturated macrocyclic ring 西姆莱斯有限公司 2020-05-15 CN disclosed
US-7901724-B2 Fermented tea obtained by tea-rolling processing of tea material leaves and loquat leaves, and composition having extract contained in fermented tea as active component NAGASAKI PREFECTURAL GOVERNMENT (JP) 2011-03-08 US disclosed
CN-101001535-B Fermented tea obtained by kneading tea material leaves and loquat leaves, and composition containing extract contained in fermented tea as effective component NAGASAKI PREFECTURE 2010-10-13 CN disclosed
US-20070190219-A1 Fermented Tea Obtained By Tea-Rolling Processing Of Tea Material Leaves And Loquat Leaves, And Composition Having Extract Contained In Fermented Tea As Active Component NAGASAKI PREFECTURAL GOVERNMENT (JP) 2007-08-16 US disclosed
CN-101001535-A Fermented tea obtained by kneading tea material leaves and loquat leaves, and composition containing extract contained in fermented tea as effective component NAGASAKI PREFECTURE (JP) 2007-07-18 CN disclosed