SCHEMBL29477290

SCHEMBL29477290

COc1cc(/C=C\C=C\C(=O)N2CCCCC2)ccc1O

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 4/20 0.84
ALOX5 P09917 4/20 0.73
MAOB P27338 4/20 0.73
KDM4E B2RXH2 2/20 0.65
ALDH1A1 P00352 2/20 0.65
KMT2A Q03164 1/20 0.65
FGFR1 P11362 1/20 0.61
ACHE P22303 8/20 0.60
CYP1A2 P05177 1/20 0.59
CYP2D6 P10635 1/20 0.59
NFKB1 P19838 1/20 0.59
HSD11B1 P28845 1/20 0.59
STAT3 P40763 1/20 0.59
NFKB2 Q00653 1/20 0.59
RELA Q04206 1/20 0.59
NFE2L2 Q16236 1/20 0.59
MAOA P21397 3/20 0.58
CAPN1 P07384 1/20 0.58
CTSL P07711 1/20 0.58
CTSB P07858 1/20 0.58

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
SCHEMBL4912827 1.00 TRPV1 (0.84) TRPV1ALOX5MAOBKDM4EALDH1A1
SCHEMBL9029032 0.91 TRPV1 (1.00) TRPV1ALOX5MAOBKDM4EALDH1A1
SCHEMBL9029039 0.91 TRPV1 (1.00) TRPV1ALOX5MAOBKDM4EALDH1A1
SCHEMBL30887530 0.91 TRPV1 (1.00) TRPV1ALOX5MAOBKDM4EALDH1A1
SCHEMBL14255225 0.90 KDM4E (0.81) TRPV1ALOX5MAOBKDM4EALDH1A1
SCHEMBL29738480 0.90 KDM4E (0.81) TRPV1ALOX5MAOBKDM4EALDH1A1
SCHEMBL16274617 0.90 KDM4E (0.81) TRPV1ALOX5MAOBKDM4EALDH1A1
SCHEMBL17327997 0.90 TRPV1 (0.97) TRPV1ALOX5KDM4EALDH1A1KMT2A
SCHEMBL6782747 0.85 KDM4E (0.76) TRPV1ALOX5MAOBKDM4EALDH1A1
SCHEMBL5029885 0.84 TRPV1 (0.87) TRPV1ALOX5KDM4EALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118948982-A Compositions comprising alpinia and other plant extracts for improving joint health and treating arthritis 尤尼根公司 2024-11-15 CN claimed
EP-4229639-A1 METHOD AND SYSTEMS FOR PHYTOMEDICINE ANALYTICS FOR RESEARCH OPTIMIZATION AT SCALE GBS Global Biopharma, Inc. (CA) 2023-08-23 EP claimed
CN-115515614-A Compositions comprising extracts of alpinia and other plants for improving joint health and treating arthritis 尤尼根公司 2022-12-23 CN claimed
EP-4100034-A1 COMPOSITIONS COMPRISING EXTRACTS OF APLINIA AND OTHER PLANTS FOR IMPROVING JOINT HEALTH AND TREATING ARTHRITIS Unigen, Inc. (US) 2022-12-14 EP claimed
WO-2022081889-A1 METHOD AND SYSTEMS FOR PHYTOMEDICINE ANALYTICS FOR RESEARCH OPTIMIZATION AT SCALE GBS GLOBAL BIOPHARMA, INC. (CA) 2022-04-21 WO claimed
CN-118948982-A Compositions comprising alpinia and other plant extracts for improving joint health and treating arthritis 尤尼根公司 2024-11-15 CN disclosed
CN-115515614-B Compositions comprising alpinia and other plant extracts for improving joint health and treating arthritis 尤尼根公司 2024-07-23 CN disclosed
CN-115515614-A Compositions comprising extracts of alpinia and other plants for improving joint health and treating arthritis 尤尼根公司 2022-12-23 CN disclosed
EP-4100034-A1 COMPOSITIONS COMPRISING EXTRACTS OF APLINIA AND OTHER PLANTS FOR IMPROVING JOINT HEALTH AND TREATING ARTHRITIS Unigen, Inc. (US) 2022-12-14 EP disclosed
US-20220130493-A1 METHOD AND SYSTEMS FOR PHYTOMEDICINE ANALYTICS FOR RESEARCH OPTIMIZATION AT SCALE GBS GLOBAL BIOPHARMA, INC. (CA) 2022-04-28 US disclosed
WO-2022081889-A1 METHOD AND SYSTEMS FOR PHYTOMEDICINE ANALYTICS FOR RESEARCH OPTIMIZATION AT SCALE GBS GLOBAL BIOPHARMA, INC. (CA) 2022-04-21 WO disclosed