SCHEMBL3153458

SCHEMBL3153458

CN(C)Cc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRHBP P24387 2/20 0.64
CRHR2 Q13324 2/20 0.64
PYCR1 P32322 1/20 0.62
LOXL2 Q9Y4K0 1/20 0.55
KCNH2 Q12809 2/20 0.54
HRH3 Q9Y5N1 1/20 0.52
TSHR P16473 1/20 0.52
IDO1 P14902 2/20 0.50
ACHE P22303 1/20 0.50
HSD17B10 Q99714 1/20 0.50
ALDH1A1 P00352 1/20 0.48
CYP2C19 P33261 1/20 0.48
POLB P06746 1/20 0.48
MAPT P10636 1/20 0.47
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA3 P07451 1/20 0.47
CA4 P22748 1/20 0.47
CA6 P23280 1/20 0.47

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
Hydrochloric Acid SCHEMBL28581917 0.98 CRHBP (0.62) CRHBPCRHR2PYCR1LOXL2KCNH2
SCHEMBL27537075 0.84 CRHBP (0.60) CRHBPCRHR2PYCR1LOXL2KCNH2
SCHEMBL3146890 0.83 KCNH2 (0.62) CRHBPCRHR2PYCR1LOXL2KCNH2
Hydrochloric Acid SCHEMBL9151033 0.83 MAPK1 (0.59) CRHBPCRHR2PYCR1HRH3ACHE
SCHEMBL15392240 0.83 LOXL2 (0.59) CRHBPCRHR2PYCR1LOXL2KCNH2
SCHEMBL3154646 0.82 PYCR1 (0.66) CRHBPCRHR2PYCR1LOXL2KCNH2
SCHEMBL3143221 0.81 CRHBP (0.71) CRHBPCRHR2PYCR1KCNH2ACHE
SCHEMBL4810294 0.81 CRHBP (0.61) CRHBPCRHR2PYCR1LOXL2KCNH2
SCHEMBL3148248 0.81 ACHE (0.64) CRHBPCRHR2PYCR1LOXL2KCNH2
SCHEMBL3152144 0.81 KCNH2 (0.68) CRHBPCRHR2PYCR1LOXL2KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119680367-A Dioxin inhibitor for mixed combustion of municipal sludge and household garbage and preparation method thereof 河南省化工研究所有限责任公司 2025-03-25 CN claimed
CN-119680367-A Dioxin inhibitor for mixed combustion of municipal sludge and household garbage and preparation method thereof 河南省化工研究所有限责任公司 2025-03-25 CN disclosed
CN-119680367-A Dioxin inhibitor for mixed combustion of municipal sludge and household garbage and preparation method thereof 河南省化工研究所有限责任公司 2025-03-25 CN disclosed
CN-117255734-A Polymer composition comprising polypropylene and hydrocarbon resin 博里利斯股份公司 2023-12-19 CN disclosed
WO-2023237759-A1 DIHYDRO[1,8]NAPHTHYRIDIN-7-ONE AND PYRIDO[3,2-B][1,4]OXAZIN-3-ONE FOR USE IN TREATING CANCER, AND METASTASES IN PARTICULAR ANAGENESIS BIOTECHNOLOGIES (FR) 2023-12-14 WO disclosed
EP-4289427-A1 DIHYDRO[1,8]NAPHTHYRIDIN-7-ONE AND PYRIDO[3,2-B][1,4]OXAZIN-3-ONE FOR USE IN TREATING CANCER, AND METASTASES IN PARTICULAR. Anagenesis Biotechnologies (FR) 2023-12-13 EP disclosed
CN-108715589-B Coumarin derivative used as caspase-3 activator and application thereof 华侨大学 2021-04-20 CN disclosed
US-10294260-B2 Tetracyclic anthraquinone derivatives TIANJIN HEMAY ONCOLOGY PHARMACEUTICAL CO., LTD. (CN) 2019-05-21 US disclosed
CN-109265453-A It is a kind of as the semicarbazones analog derivative of caspase-3 activator and its application 华侨大学 2019-01-25 CN disclosed
CN-108715589-A A kind of coumarin derivatives and its application as caspase-3 activator 华侨大学 2018-10-30 CN disclosed
WO-1999062882-A1 SUBSTITUTED INDOLINONES, THE PRODUCTION THEREOF AND THEIR USE AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA KG (DE) 1999-12-09 WO disclosed
WO-1999032100-A2 PHARMACEUTICAL COMPOSITION FOR ANTAGONIZING CCR5 COMPRISING ANILIDE DERIVATIVE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-07-01 WO disclosed
WO-1999032468-A1 ANILIDE DERIVATIVE, PRODUCTION AND USE THEREOF TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-07-01 WO disclosed
CN-1043766-C Indole derivative and preparation and pharmaceutical using of same TORAY INDUSTRIES (JP) 1999-06-23 CN disclosed
US-5852030-A Indole derivatives, process for producing the same and medicinal uses of the same TORAY INDUSTRIES, INC. (JP) 1998-12-22 US disclosed
CN-1092425-A Indole derivatives, its manufacture method and medicinal use thereof TORAY INDUSTRIES (JP) 1994-09-21 CN disclosed
EP-0614898-A1 INDOLE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND MEDICINAL USE THEREOF TORAY INDUSTRIES, INC. (JP) 1994-09-14 EP disclosed
US-4268439-A Basic azo dyestuffs having benzylammoniumamine substituent in the coupling component BAYER AKTIENGESELLSCHAFT (DE) 1981-05-19 US disclosed
US-4193800-A COLOR DIFFUSION TRANSFER, POLYMER HAVING ACRYLOLAMINOPHENYL AMMONIUM UNITS KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1980-03-18 US disclosed
US-4147548-A Photographic element comprising quaternary nitrogen polymeric mordant FUJI PHOTO FILM CO., LTD. (JP) 1979-04-03 US disclosed

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-10294260-B2 Tetracyclic anthraquinone derivatives H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, F12, ANTXR2 CRHBP 4758/4885CRHR2 3606/4885PYCR1 602/4885

“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.