SCHEMBL29456643

SCHEMBL29456643

C=C1C=C[C@H]([C@H](C)CCC=C(C)C)CC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1I2 O75469 1/20 0.37
PTPN1 P18031 3/20 0.36
MGAM O43451 1/20 0.36
GAA P10253 1/20 0.36
SI P14410 1/20 0.36
MGAM2 Q2M2H8 1/20 0.36
METAP2 P50579 1/20 0.35
GLA P06280 1/20 0.35
HPGD P15428 1/20 0.35
BID P55957 6/20 0.34
BCL2L1 Q07817 6/20 0.34
MCL1 Q07820 6/20 0.34
BAK1 Q16611 6/20 0.34
BCL2 P10415 1/20 0.34
ALDH1A1 P00352 2/20 0.33
ALOX15 P16050 2/20 0.33
USP2 O75604 1/20 0.33
LMNA P02545 1/20 0.33
CYP3A4 P08684 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL31509221 1.00 NR1I2 (0.37) NR1I2PTPN1MGAMGAASI
SCHEMBL17627721 1.00 NR1I2 (0.37) NR1I2PTPN1MGAMGAASI
SCHEMBL156324 1.00 NR1I2 (0.37) NR1I2PTPN1MGAMGAASI
SCHEMBL29349988 1.00 NR1I2 (0.37) NR1I2PTPN1MGAMGAASI
SCHEMBL158316 1.00 NR1I2 (0.37) NR1I2PTPN1MGAMGAASI
SCHEMBL31509414 1.00 NR1I2 (0.37) NR1I2PTPN1MGAMGAASI
SCHEMBL15786477 0.83 METAP2 (0.40) PTPN1MGAMGAASIMGAM2
SCHEMBL15786478 0.83 METAP2 (0.40) PTPN1MGAMGAASIMGAM2
SCHEMBL2947379 0.83 METAP2 (0.40) PTPN1MGAMGAASIMGAM2
SCHEMBL31473473 0.77 PTPN1 (0.37) NR1I2PTPN1MGAMGAASI

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4593977-A1 PRODUCTS AND METHODS RELATED TO THE DISTILLATION OF MOLECULES FROM AEROSOLS Natural Extraction Systems, LLC (US) 2025-08-06 EP claimed
CN-118340759-B Compound essential oil for relieving primary dysmenorrhea and preparation method thereof 颇黎芳香医药科技(上海)有限公司 2025-04-11 CN claimed
EP-4096618-B1 A MIXTURE COMPRISING 1,2-ALKANEDIOLS SYMRISE AG (DE) 2025-01-29 EP claimed
EP-3152321-B1 DIAGNOSIS AND TREATMENT OF INVASIVE ASPERGILLOSIS BRIGHAM & WOMENS HOSPITAL INC (US) 2024-11-13 EP claimed
EP-4438065-A2 A MIXTURE COMPRISING 1,2-ALKANEDIOLS Symrise AG (DE) 2024-10-02 EP claimed
CN-118340759-A Compound essential oil for relieving primary dysmenorrhea and preparation method thereof 颇黎芳香医药科技(上海)有限公司 2024-07-16 CN claimed
US-20240189737-A1 COMPOSITIONS FOR LOW-TEMPERATURE DISTILLATION OF HIGH-BOILING-POINT MOLECULES Natural Extraction Systems, LLC 2024-06-13 US claimed
US-20240181369-A1 PRODUCTS AND METHODS RELATED TO THE DISTILLATION OF MOLECULES FROM AEROSOLS Natural Extraction Systems, LLC 2024-06-06 US claimed
WO-2024073141-A1 PRODUCTS AND METHODS RELATED TO THE DISTILLATION OF MOLECULES FROM AEROSOLS Natural Extraction Systems, LLC (US) 2024-04-04 WO claimed
WO-2024073146-A2 COMPOSITIONS FOR LOW-TEMPERATURE DISTILLATION OF HIGH-BOILING-POINT MOLECULES Natural Extraction Systems, LLC (US) 2024-04-04 WO claimed
CN-116148375-A Method for detecting turmeric and/or its extract 四川省中医药科学院 2023-05-23 CN claimed
EP-4096618-A1 A MIXTURE COMPRISING 1,2-ALKANEDIOLS Symrise AG (DE) 2022-12-07 EP claimed
US-20220364016-A1 PERFUME OIL MIXTURE SYMRISE AG (DE) 2022-11-17 US claimed
WO-2022229784-A1 MIXTURES OF EMULSIFIED TERPENES HAVING ANTIBACTERIAL AND ANTIFUNGAL ACTIVITY VILLAGOMEZ DIAZ, Jennifer Paulina (EC) 2022-11-03 WO claimed
WO-2022212898-A1 COMPOSITIONS FOR LOW-TEMPERATURE DISTILLATION OF HIGH-BOILING-POINT MOLECULES Natural Extraction Systems, LLC (US) 2022-10-06 WO claimed
WO-2022212912-A1 PRODUCTS AND METHODS RELATED TO THE DISTILLATION OF MOLECULES FROM AEROSOLS Natural Extraction Systems, LLC (US) 2022-10-06 WO claimed
EP-4013438-A1 HERBAL PREPARATION FOR STIMULATION OF HAIR GROWTH, CONTROL OF HAIR FALL, DANDRUFF AND INFECTIONS THEREOF USING AGERATUM SPP GE Nutrients, Inc. (US) 2022-06-22 EP claimed
WO-2022122143-A1 A MIXTURE COMPRISING 1,2-ALKANEDIOLS SYMRISE AG (DE) 2022-06-16 WO claimed
WO-2022112430-A1 REDUCTION OF VIRAL INFECTIONS PHOXBIO LIMITED (IE) 2022-06-02 WO claimed
CN-114555104-A Herbal preparation for stimulating hair growth, controlling hair loss, dandruff and infections thereof using ageratum species GE营养有限公司 2022-05-27 CN claimed