SCHEMBL418143

SCHEMBL418143

C1=Cc2ncc3ccc4ccccc4c3c2CC1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.33
GPR3 P46089 1/20 0.33
ALDH1A1 P00352 3/20 0.32
TSHR P16473 2/20 0.32
HSD17B10 Q99714 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
CYP2A6 P11509 1/20 0.32
RAB9A P51151 3/20 0.31
CYP3A4 P08684 2/20 0.31
HPGD P15428 2/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
MAPK1 P28482 1/20 0.31
CASP1 P29466 1/20 0.31
CASP7 P55210 1/20 0.31
ATM Q13315 1/20 0.31
HIF1A Q16665 1/20 0.31
MAPT P10636 4/20 0.31
CYP1A2 P05177 1/20 0.31
LCK P06239 1/20 0.31
FYN P06241 1/20 0.31

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
SCHEMBL29617599 1.00 KDM4E (0.33) KDM4EGPR3ALDH1A1TSHRHSD17B10
Water SCHEMBL28095816 0.98 KDM4E (0.32) KDM4EGPR3ALDH1A1TSHRHSD17B10
SCHEMBL976367 0.84 KDM4E (0.40) KDM4EGPR3ALDH1A1HSD17B10TDP1
SCHEMBL30343302 0.83 KDM4E (0.39) KDM4EGPR3TDP1
D-Glutamate SCHEMBL2036307 0.80 MC4R (0.36) KDM4EALDH1A1TSHRCYP1A2ACHE
SCHEMBL28440790 0.77 TDP1 (0.35) KDM4EGPR3TDP1CYP2A6CYP1A2
SCHEMBL15994595 0.72 TDP1 (0.39) KDM4EGPR3ALDH1A1TSHRHSD17B10
SCHEMBL27575535 0.69 HPRT1 (0.41) KDM4EALDH1A1TSHRHSD17B10TDP1
SCHEMBL1893653 0.68 HSD17B10 (0.41) KDM4EALDH1A1TSHRHSD17B10TDP1
SCHEMBL23018970 0.68 CYP2A6 (0.36) ALDH1A1CYP2A6CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024177860-A1 IN CHEMICO TEST FOR TOXICITY LEBRUN LABS LLC (US) 2024-08-29 WO claimed
US-20240260865-A1 METHOD OF PRODUCING THIN ENZYME-BASED SENSING LAYERS ON PLANAR SENSORS CALIFORNIA INSTITUTE OF TECHNOLOGY 2024-08-08 US claimed
US-11969246-B2 Method of producing thin enzyme-based sensing layers on planar sensors CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2024-04-30 US claimed
US-11903708-B2 Switchable low voltage electrochemical sensing for interfering species rejection CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2024-02-20 US claimed
CN-114426929-B Yeast engineering bacteria for producing sanguinarine by fermentation and application thereof 浙江大学 2024-02-02 CN claimed
US-20230363672-A1 METHOD OF PRODUCING THIN ENZYME-BASED SENSING LAYERS ON PLANAR SENSORS CALIFORNIA INSTITUTE OF TECHNOLOGY 2023-11-16 US claimed
US-11690544-B2 Method of producing thin enzyme-based sensing layers on planar sensors CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2023-07-04 US claimed
CN-115304611-B Dihydrobenzophenanthridine alkaloid compound in radix zanthoxyli, and extraction method and application thereof 广西师范大学 2023-06-02 CN claimed
CN-113816967-B Method, composition and application of bio-orthogonal photocatalytic oxidative dehydrogenation activated antitumor compound 华南理工大学 2023-04-21 CN claimed
CN-115304611-A Two pairs of dihydrobenzophenanthridine alkaloid compounds in radix zanthoxyli and extraction method and application thereof 广西师范大学 2022-11-08 CN claimed
CN-111171039-B Oxidative dehydrogenation method of compound with cell nucleus targeting light activation imaging and cancer cell killing capacity and application 华南理工大学 2022-10-25 CN claimed
US-20220218639-A1 TUNEABLE DELIVERY OF NANOPARTICLE BOUND ACTIVE PLASMIN FOR THE TREATMENT OF THROMBOSIS INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION 2022-07-14 US claimed
CN-114426929-A Yeast engineering bacterium for producing sanguinarine through fermentation and application thereof 浙江大学 2022-05-03 CN claimed
CN-113816967-A Method for activating anti-tumor compound through biological orthogonal photocatalytic oxidative dehydrogenation, composition and application 华南理工大学 2021-12-21 CN claimed
CN-110437243-B Method for extracting and separating six dihydrobenzophenanthridine alkaloids from macleaya microcarpa 湖南农业大学 2020-08-14 CN claimed
CN-111171039-A Oxidative dehydrogenation method of compound with cell nucleus targeting light activation imaging and cancer cell killing capacity and application 华南理工大学 2020-05-19 CN claimed
CN-110437243-A A method of extracting six kinds of dihydrobenzo phenanthridine alkaloids of separation from macleaya microcarpa Fedde UNIV HUNAN AGRICULTURAL 2019-11-12 CN claimed
CN-110054612-A A kind of electroluminescent organic material and its application characterized by dihydrobenzo phenanthridines and benzo-aza ring 中节能万润股份有限公司 2019-07-26 CN claimed
CN-109468351-A The method of efficient Enzyme catalyzed synthesis sanguinarine and Chelerythrine 湖南美可达生物资源股份有限公司 2019-03-15 CN claimed
CN-109468350-A The method for synthesizing sanguinarine and Chelerythrine as substrate using macleaya cordata blade stoste 湖南美可达生物资源股份有限公司 2019-03-15 CN claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220218639-A1 TUNEABLE DELIVERY OF NANOPARTICLE BOUND ACTIVE PLASMIN FOR THE TREATMENT OF THROMBOSIS PLAT, PLG, PLAUR KDM4E 4129/4885GPR3 3230/4885ALDH1A1 4138/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.