SCHEMBL29359402

SCHEMBL29359402

COC(=O)C1=C(C)NC(C)=C([N+](=O)[O-])C1c1ccccc1C(F)(F)F

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 5/20 1.00
ADORA3 P0DMS8 5/20 1.00
MAPT P10636 5/20 1.00
CACNA1C Q13936 5/20 1.00
CYP3A4 P08684 4/20 1.00
CYP2C9 P11712 4/20 1.00
CYP2C19 P33261 4/20 1.00
TSHR P16473 3/20 1.00
NFKB1 P19838 3/20 1.00
CYP2D6 P10635 2/20 1.00
KMT2A Q03164 2/20 1.00
MEN1 O00255 1/20 1.00
CACNA1F O60840 3/20 0.62
CACNA1D Q01668 3/20 0.62
CACNA1S Q13698 3/20 0.62
ABCC4 O15439 2/20 0.61
ABCB11 O95342 2/20 0.61
LMNA P02545 2/20 0.61
ADORA2A P29274 2/20 0.61
ADORA1 P30542 2/20 0.61

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
SCHEMBL718828 1.00 CYP1A2 (1.00) CYP1A2ADORA3MAPTCACNA1CCYP3A4
SCHEMBL2845539 1.00 CYP1A2 (1.00) CYP1A2ADORA3MAPTCACNA1CCYP3A4
SCHEMBL30897545 1.00 CYP1A2 (1.00) CYP1A2ADORA3MAPTCACNA1CCYP3A4
SCHEMBL133106 1.00 CYP1A2 (1.00) CYP1A2ADORA3MAPTCACNA1CCYP3A4
SCHEMBL14612812 0.90 CYP1A2 (0.82) CYP1A2ADORA3MAPTCACNA1CCYP3A4
SCHEMBL7265346 0.89 CYP1A2 (0.80) CYP1A2ADORA3MAPTCACNA1CCYP3A4
SCHEMBL11369967 0.89 CYP1A2 (0.79) CYP1A2ADORA3MAPTCACNA1CCYP3A4
SCHEMBL11004406 0.89 CYP1A2 (0.79) CYP1A2ADORA3MAPTCACNA1CCYP3A4
SCHEMBL7272013 0.88 MAPT (0.79) CYP1A2ADORA3MAPTCACNA1CCYP3A4
SCHEMBL28830138 0.87 MAPT (0.78) CYP1A2ADORA3MAPTCACNA1CCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116355836-B Bile duct trunk cell expansion or passage system and application thereof 上海市东方医院(同济大学附属东方医院) 2026-05-19 CN claimed
US-12570957-B2 Isolated naive pluripotent stem cells and methods of generating same YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2026-03-10 US claimed
US-20250222028-A1 ENGINEERED IMMUNE CELL PLATFORM CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2025-07-10 US claimed
US-20250152531-A1 INHIBITORS OF AUTOPHAGY AND DCAR-1 AS NOVEL ANTHELMINTIC AGENTS FLORIDA ATLANTIC UNIVERSITY BOARD OF TRUSTEES 2025-05-15 US claimed
US-12233036-B2 Inhibitors of autophagy and DCAR-1 as novel anthelmintic agents FLORIDA ATLANTIC UNIVERSITY BOARD OF TRUSTEES (US) 2025-02-25 US claimed
EP-4499135-A1 ENGINEERED IMMUNE CELL PLATFORM Cancer Research Technology Limited (GB) 2025-02-05 EP claimed
CN-119314440-A High PPI HDM flicker adjustment process 无锡夏普显示科技有限公司 2025-01-14 CN claimed
CN-119274499-A Automatic debugging method, system, device and terminal for automatic backlight curve 四川酷比通信设备有限公司 2025-01-07 CN claimed
CN-119013039-A Engineered immune cell platform 癌症研究技术有限公司 2024-11-22 CN claimed
US-20240318144-A1 MEDIA FOR CULTURING NAIVE HUMAN PLURIPOTENT STEM CELLS YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2024-09-26 US claimed
CN-116844461-A Color difference adjusting method and system for spliced screen 深圳新视光电科技有限公司 2023-10-03 CN claimed
CN-116774472-A Method and system for evaluating graphic effect of liquid crystal display 深圳市巨潮科技股份有限公司 2023-09-19 CN claimed
CN-116777876-A Image quality evaluation method and system for medical image display equipment 深圳市巨潮科技股份有限公司 2023-09-19 CN claimed
US-11730769-B2 Compositions and methods for Williams Syndrome (WS) therapy CHILDREN'S MEDICAL CENTER CORPORATION (US) 2023-08-22 US claimed
CN-116355836-A Bile duct trunk cell expansion or passage system and application thereof 上海市东方医院(同济大学附属东方医院) 2023-06-30 CN claimed
US-11572540-B2 Method for inducing oligodendrocyte precursor cells from OCT4-induced human somatic cells through direct reprogramming Stemlab Inc. (KR) 2023-02-07 US claimed
WO-2022254442-A1 MEANS AND METHODS FOR IMPROVING ANTI-TUMORAL EFFICACY OF TRANSMEMBRANE CHANNEL PROTEIN BLOCKERS ARDAN PHARMA S.A.S. (AR) 2022-12-08 WO claimed
CN-113151157-B Passage method and application of endoderm stem/progenitor cells obtained by reprogramming epithelial cells derived from digestive tract 中国人民解放军军事医学科学院野战输血研究所 2022-06-28 CN claimed
US-11332716-B2 Methods and compositions for producing pancreatic beta cells THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2022-05-17 US claimed
WO-2022065859-A1 METHOD FOR DIRECT REPROGRAMMING FROM SOMATIC CELLS INTO PANCREATIC BETA CELLS BY USING MICRORNA, AND DIFFERENTIATION COMPOSITION 성균관대학교산학협력단 2022-03-31 WO 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 (4 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-11730769-B2 Compositions and methods for Williams Syndrome (WS) therapy MAG, PMP22, WDR77 CYP1A2 4855/4885ADORA3 4569/4885MAPT 1134/4885
US-12570957-B2 Isolated naive pluripotent stem cells and methods of generating same GSK3B, EZH2, GSK3A CYP1A2 4392/4885ADORA3 3689/4885MAPT 1643/4885
US-11332716-B2 Methods and compositions for producing pancreatic beta cells IAPP, ALPG, AMY2A CYP1A2 4820/4885ADORA3 3401/4885MAPT 4517/4885
US-20250222028-A1 ENGINEERED IMMUNE CELL PLATFORM CACNA1C, CACNA1S, CACNB1 CYP1A2 4421/4885ADORA3 1038/4885MAPT 3168/4885

“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.