SCHEMBL1070327

SCHEMBL1070327

CCN=C=NCCC(C)C

nearest known ligand 0.45

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.45
▸ CYP2D6 P10635 1/20 0.45

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 SCHEMBL2237701 0.98 CYP1A2 (0.43) CYP1A2CYP2D6
SCHEMBL8710761 0.89 TRPA1 (0.33) CYP1A2CYP2D6
SCHEMBL12320902 0.86 CYP1A2 (0.52) CYP1A2CYP2D6
SCHEMBL15490347 0.81 CYP1A2 (0.42) CYP1A2CYP2D6
Hydrochloric Acid SCHEMBL5703512 0.79 CYP1A2 (0.41) CYP1A2CYP2D6
SCHEMBL266057 0.78 CYP1A2 (0.43) CYP1A2CYP2D6
SCHEMBL7986350 0.78 CYP1A2 (0.48) CYP1A2CYP2D6
Imidazole SCHEMBL28771940 0.77 ALDH1A1 (0.38) CYP1A2CYP2D6
Hydrochloric Acid SCHEMBL496494 0.76 CYP1A2 (0.42) CYP1A2CYP2D6
Hydrochloric Acid SCHEMBL23701383 0.76 CYP1A2 (0.38) CYP1A2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116284207-A Fluorinated modified antibacterial peptide and preparation method and application thereof 广州工业智能研究院 2023-06-23 — — CN claimed
CN-112014449-B Method for detecting luteolin by combining solid-phase extraction and electrochemical sensor 青岛农业大学 2022-10-25 — — CN claimed
CN-112684065-B ZrO 2 Three-dimensional graphene material modified by nano particles and application of three-dimensional graphene material in organophosphorus pesticide detection 青岛农业大学 2022-08-05 — — CN claimed
CN-109116014-B Janus particle-based electrochemical immunosensor and preparation method and application thereof 山西大学 2021-09-28 — — CN claimed
CN-112684065-A ZrO2Three-dimensional graphene material modified by nano particles and application of three-dimensional graphene material in organophosphorus pesticide detection 青岛农业大学 2021-04-20 — — CN claimed
CN-112014449-A Method for detecting luteolin by combining solid-phase extraction and electrochemical sensor 青岛农业大学 2020-12-01 — — CN claimed
CN-110665009-A Nanometer gemcitabine for promoting normalization of tumor blood vessels and application thereof 中国药科大学 2020-01-10 — — CN claimed
CN-109116014-A A kind of electrochemical immunosensor and its preparation method and application based on Janus particle 山西大学 2019-01-01 — — CN claimed
CN-108744591-A The extracting process of chromocor compound 中国石油化工股份有限公司 2018-11-06 — — CN claimed
CN-106727323-A A kind of hyaluronic acid nanometer vesica and its preparation method and application 郑州大学 2017-05-31 — — CN claimed
CN-1900144-A Poly propenoic acid/polypeptide grafted copolymer and its preparing method and use UNIV EAST CHINA SCI & ENG (CN) 2007-01-24 — — CN claimed
US-7166213-B2 Solid compositions for selective adsorption from complex mixtures W. R. GRACE & CO.-CONN. (US) 2007-01-23 — — US claimed
US-6998042-B2 Solid compositions for selective adsorption from complex mixtures ALLTECH ASSOCIATES, INC. (US) 2006-02-14 — — US claimed
US-20060011549-A1 Solid compositions for selective adsorption from complex mixtures W. R. GRACE & CO.-CONN. 2006-01-19 — — US claimed
CN-1568222-A Solid compositions for selective adsorption from complex mixtures GRACE W R & CO (US) 2005-01-19 — — CN claimed
US-20050003428-A1 Solid compositions for selective adsorption from complex mixtures ALLTECH ASSOCIATES, INC. 2005-01-06 — — US claimed
JP-2004538479-A — — 2004-12-24 — — JP claimed
EP-1423191-A1 SOLID COMPOSITIONS FOR SELECTIVE ADSORPTION FROM COMPLEX MIXTURES W.R. Grace & Co. (US) 2004-06-02 — — EP claimed
US-20030042203-A1 Solid compositions for selective adsorption from complex mixtures W.R. GRACE & CO.-CONN. 2003-03-06 — — US claimed
WO-2003015915-A1 SOLID COMPOSITIONS FOR SELECTIVE ADSORPTION FROM COMPLEX MIXTURES W.R. GRACE & CO.-CONN. (US) 2003-02-27 — — WO claimed
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