SCHEMBL3400313

SCHEMBL3400313

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

nearest known ligand 0.65

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.65
ALOX15 P16050 3/20 0.64
ALDH1A1 P00352 2/20 0.64
MEN1 O00255 2/20 0.60
CYP3A4 P08684 2/20 0.60
MAPT P10636 2/20 0.58
UGT1A1 P22309 1/20 0.58
SQLE Q14534 3/20 0.56
FNTA P49354 5/20 0.55
FNTB P49356 3/20 0.55
KDM4E B2RXH2 1/20 0.52
PGGT1B P53609 2/20 0.51
GGPS1 O95749 1/20 0.50

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
SCHEMBL492962 1.00 KMT2A (0.65) KMT2AALOX15ALDH1A1MEN1CYP3A4
SCHEMBL27649625 1.00 KMT2A (0.65) KMT2AALOX15ALDH1A1MEN1CYP3A4
SCHEMBL492960 1.00 KMT2A (0.65) KMT2AALOX15ALDH1A1MEN1CYP3A4
SCHEMBL28854298 1.00 KMT2A (0.65) KMT2AALOX15ALDH1A1MEN1CYP3A4
SCHEMBL23530356 0.98 KMT2A (0.62) KMT2AALOX15ALDH1A1MEN1CYP3A4
SCHEMBL5320561 0.98 KMT2A (0.70) KMT2AALOX15ALDH1A1MEN1CYP3A4
SCHEMBL6061920 0.98 KMT2A (0.70) KMT2AALOX15ALDH1A1MEN1CYP3A4
SCHEMBL30531902 0.98 KMT2A (0.70) KMT2AALOX15ALDH1A1MEN1CYP3A4
SCHEMBL11851208 0.98 KMT2A (0.70) KMT2AALOX15ALDH1A1MEN1CYP3A4
SCHEMBL28008995 0.98 KMT2A (0.70) KMT2AALOX15ALDH1A1MEN1CYP3A4

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116003219-B Method for synthesizing nerol geraniol by synergistic catalysis 江苏宏邦化工科技有限公司 2024-07-02 CN claimed
CN-116003219-A Method for synthesizing nerol geraniol by synergistic catalysis 江苏宏邦化工科技有限公司 2023-04-25 CN claimed
US-6423541-B1 GROWING HETEROGENOUS POPULATION OF MENTHA CLONES; TRANSFERRING SHOOTS WITH TOXIC COMPOUNDS; SELECTING SURVIVING CLONES; HARDENING IN GLASSHOUSE; MULTIPLYING; CONFIRMING GENETIC UNIFORMITY; HIGH SPEED COUNCIL OF SCIENTIFIC&INDUSTRIAL REAEARCH (IN) 2002-07-23 US claimed
CN-116003219-B Method for synthesizing nerol geraniol by synergistic catalysis 江苏宏邦化工科技有限公司 2024-07-02 CN disclosed
CN-116003219-B Method for synthesizing nerol geraniol by synergistic catalysis 江苏宏邦化工科技有限公司 2024-07-02 CN disclosed
CN-116003219-B Method for synthesizing nerol geraniol by synergistic catalysis 江苏宏邦化工科技有限公司 2024-07-02 CN disclosed
CN-116174051-A Alpha, beta-unsaturated aldehyde or ketone hydrogenation method 中国科学院大连化学物理研究所 2023-05-30 CN disclosed
CN-114057544-B Method for preparing nerol and geraniol from citral 万华化学集团股份有限公司 2023-05-30 CN disclosed
CN-116003219-A Method for synthesizing nerol geraniol by synergistic catalysis 江苏宏邦化工科技有限公司 2023-04-25 CN disclosed
CN-116003219-A Method for synthesizing nerol geraniol by synergistic catalysis 江苏宏邦化工科技有限公司 2023-04-25 CN disclosed
CN-116003219-A Method for synthesizing nerol geraniol by synergistic catalysis 江苏宏邦化工科技有限公司 2023-04-25 CN disclosed
EP-2244579-A2 DOMESTIC ANIMAL PARASITE-REPELLENT DEVICE AB7 Industries SA (FR) 2010-11-03 EP disclosed
WO-2009080909-A2 DOMESTIC ANIMAL PARASITE-REPELLENT DEVICE AB7 INDUSTRIES SA (FR) 2009-07-02 WO disclosed
EP-1131440-A2 PROCESS FOR OXIDISING TERPENES ISIS INNOVATION LIMITED (GB) 2001-09-12 EP disclosed
US-6106872-A HYDROLYSIS OF GLYCOSIDES TO FORM MONOGLYCOSIDES AND ENZYME HYDROLYSIS GIST-BROCADES NV (NL) 2000-08-22 US disclosed
WO-2000031273-A2 PROCESS FOR OXIDISING TERPENES ISIS INNOVATION LIMITED (GB) 2000-06-02 WO disclosed
EP-0955994-A1 FRAGRANCE DELIVERY SYSTEMS FOR PERSONAL CARE ARTICLES THE PROCTER & GAMBLE COMPANY (US) 1999-11-17 EP disclosed
WO-1998007407-A1 FRAGRANCE DELIVERY SYSTEMS FOR PERSONAL CARE ARTICLES THE PROCTER & GAMBLE COMPANY (US) 1998-02-26 WO disclosed
US-5573926-A HYDROLYSIS GIST-BROCADES, N.V. (NL) 1996-11-12 US disclosed
EP-0422968-A1 Hydrogenation of citral Institut Français du Pétrole (FR) 1991-04-17 EP disclosed