SCHEMBL29359310

SCHEMBL29359310

C=C1C(=O)O[C@@H]2C[C@@H](C)[C@@H]3CC(=O)OC[C@@]3(C)C[C@H]12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 2/20 0.51
▸ MAPT P10636 4/20 0.49
▸ RAB9A P51151 4/20 0.49
▸ NPC1 O15118 3/20 0.49
▸ XBP1 P17861 3/20 0.49
▸ HTT P42858 3/20 0.49
▸ MDM2 Q00987 3/20 0.49
▸ PKM P14618 1/20 0.46
▸ RECQL P46063 1/20 0.46
▸ TDP1 Q9NUW8 2/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ STAT3 P40763 1/20 0.40
▸ NLRP3 Q96P20 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ TERT O14746 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ GLA P06280 1/20 0.36
▸ POLB P06746 1/20 0.36

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
SCHEMBL2102873 1.00 PTGS2 (0.51) PTGS2MAPTRAB9ANPC1XBP1
SCHEMBL30402377 0.72 MAPT (0.55) PTGS2MAPTRAB9ANPC1XBP1
SCHEMBL31626700 0.72 PTGS2 (0.59) PTGS2MAPTRAB9ANPC1XBP1
Confertin SCHEMBL30139341 0.72 PTGS2 (0.59) PTGS2MAPTRAB9ANPC1XBP1
Graveolide SCHEMBL31279270 0.72 PTGS2 (0.59) PTGS2MAPTRAB9ANPC1XBP1
SCHEMBL28044817 0.72 PTGS2 (0.59) PTGS2MAPTRAB9ANPC1XBP1
Pseudoguaianolide SCHEMBL31387995 0.71 PTGS2 (0.55) PTGS2MAPTRAB9ANPC1XBP1
SCHEMBL6424628 0.69 PTGS2 (0.53) PTGS2MAPTRAB9ANPC1XBP1
Burrodin SCHEMBL30072218 0.68 PTGS2 (1.00) PTGS2MAPTRAB9ANPC1XBP1
SCHEMBL31237447 0.68 PTGS2 (0.57) PTGS2MAPTRAB9ANPC1XBP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250367206-A1 1-METHYLXANTHINE-BASED BIOACTIVE COMPOSITION AND METHOD OF USE THEREOF Ingenious Ingredients, LP (US) 2025-12-04 — — US claimed
US-12390470-B2 1-methylxanthine-based bioactive composition and method of use thereof Ingenious Ingredients, LP (US) 2025-08-19 — — US claimed
EP-4313056-A1 THE USE OF PARAXANTHINE TO IMPROVE PERFORMANCE IN VIDEO GAMERS PX ING, LLC (US) 2024-02-07 — — EP claimed
EP-4312801-A1 PARAXANTHINE-BASED COMPOSITIONS FOR PROMOTING WEIGHT LOSS PX ING, LLC (US) 2024-02-07 — — EP claimed
EP-3308639-B1 SPATHIPHYLLUM HAVING REDUCED POLLEN CONTENT AND METHOD FOR THE PREPARATION THEREOF KP HOLLAND LICENSING B V (NL) 2023-12-20 — — EP claimed
WO-2023064511-A9 PARAXANTHINE-BASED BIOACTIVE COMPOSITION AND METHOD OF USE THEREOF Ingenious Ingredients, LP (US) 2023-06-08 — — WO claimed
WO-2023064511-A1 PARAXANTHINE-BASED BIOACTIVE COMPOSITION AND METHOD OF USE THEREOF Ingenious Ingredients, LP (US) 2023-04-20 — — WO claimed
US-20230115966-A1 PARAXANTHINE-BASED BIOACTIVE COMPOSITION AND METHOD OF USE THEREOF PX ING, LLC 2023-04-13 — — US claimed
CN-115684479-A Research method for nitrogen and phosphorus absorption kinetic characteristics of six plants in bioretention pond 悉地(苏州)勘察设计顾问有限公司 2023-02-03 — — CN claimed
CN-112336715-B Application of inula britannica extract in preparation of medicine for treating swine pleuropneumonia actinobacillus 青岛嘉智生物技术有限公司 2022-11-04 — — CN claimed
US-20220331327-A1 THE USE OF PARAXANTHINE TO IMPROVE PERFORMANCE IN VIDEO GAMERS PX ING, LLC 2022-10-20 — — US claimed
US-20220331328-A1 1-METHYLXANTHINE-BASED BIOACTIVE COMPOSITION AND METHOD OF USE THEREOF Ingenious Ingredients, LP 2022-10-20 — — US claimed
WO-2022212770-A1 THE USE OF PARAXANTHINE TO IMPROVE PERFORMANCE IN VIDEO GAMERS Ingenious Ingredients, LP (US) 2022-10-06 — — WO claimed
WO-2022204180-A1 PARAXANTHINE-BASED COMPOSITIONS FOR PROMOTING WEIGHT LOSS Ingenious Ingredients, LP (US) 2022-09-29 — — WO claimed
US-20220305019-A1 PARAXANTHINE-BASED COMPOSITIONS FOR PROMOTING WEIGHT LOSS PX ING, LLC 2022-09-29 — — US claimed
CN-113087300-B High-efficiency nitrogen and phosphorus removal composite artificial wetland system 苏州科技大学 2022-09-27 — — CN claimed
CN-114010668-A Preparation method of caulis sinomenii extract and application of caulis sinomenii extract in preparation of anti-T2 DM product 云南民族大学 2022-02-08 — — CN claimed
EP-3943085-A2 TOMM6-INTERACTING EXTRACTS AND COMPOUNDS FOR USE IN THE TREATMENT AND PROPHYLAXIS OF NERVOUS SYSTEM DISEASES, ATHEROSCLEROSIS, HEPATITIS B INFECTION AND HUMAN PAPILLOMA VIRUS (HPV) INFECTION ETH Zurich (CH) 2022-01-26 — — EP claimed
CN-122060073-A Chimeric shuttle receptors 深圳市湾岛细胞科技有限公司 2026-05-19 — — CN disclosed
EP-3943085-A2 TOMM6-INTERACTING EXTRACTS AND COMPOUNDS FOR USE IN THE TREATMENT AND PROPHYLAXIS OF NERVOUS SYSTEM DISEASES, ATHEROSCLEROSIS, HEPATITIS B INFECTION AND HUMAN PAPILLOMA VIRUS (HPV) INFECTION ETH Zurich (CH) 2022-01-26 — — EP disclosed
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