SCHEMBL4943479

SCHEMBL4943479

N#CC(C#N)=Cc1cccc([N+](=O)[O-])c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.63
CYP3A4 P08684 2/20 0.63
HIF1A Q16665 1/20 0.63
FBP1 P09467 2/20 0.60
ALDH1A1 P00352 7/20 0.60
MAPT P10636 5/20 0.60
RAB9A P51151 1/20 0.60
GLO1 Q04760 1/20 0.59
KDM4E B2RXH2 6/20 0.59
LMNA P02545 5/20 0.59
KMT2A Q03164 5/20 0.59
HPGD P15428 3/20 0.57
EGFR P00533 2/20 0.57
RECQL P46063 2/20 0.57
POLB P06746 1/20 0.57
CYP2C9 P11712 1/20 0.57
BLM P54132 1/20 0.57
HSD17B10 Q99714 1/20 0.57
TDP1 Q9NUW8 1/20 0.57
NFE2L2 Q16236 1/20 0.54

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
SCHEMBL29894113 1.00 CYP1A2 (0.63) CYP1A2CYP3A4HIF1AFBP1ALDH1A1
SCHEMBL5805642 0.92 CYP1A2 (0.59) CYP1A2CYP3A4HIF1AFBP1ALDH1A1
SCHEMBL5805641 0.92 CYP1A2 (0.59) CYP1A2CYP3A4HIF1AFBP1ALDH1A1
SCHEMBL5805643 0.83 CYP1A2 (0.59) CYP1A2CYP3A4HIF1AFBP1ALDH1A1
SCHEMBL9364797 0.82 KDM4E (0.67) CYP1A2CYP3A4HIF1AFBP1ALDH1A1
SCHEMBL17397040 0.82 KDM4E (0.67) CYP1A2CYP3A4HIF1AFBP1ALDH1A1
SCHEMBL17397039 0.82 KDM4E (0.67) CYP1A2CYP3A4HIF1AFBP1ALDH1A1
SCHEMBL9364793 0.82 KDM4E (0.67) CYP1A2CYP3A4HIF1AFBP1ALDH1A1
SCHEMBL8543761 0.81 MAPT (0.70) CYP1A2CYP3A4HIF1AFBP1ALDH1A1
SCHEMBL8543768 0.81 MAPT (0.70) CYP1A2CYP3A4HIF1AFBP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1744370-A2 Electric field programmable films and memory devices based thereon Rohm and Haas Electronic Materials LLC (US) 2007-01-17 EP claimed
US-20070009201-A1 Electric field programmable films and memory devices based thereon ROHM AND HAAS ELECTRONIC MATERIALS LLC (US) 2007-01-11 US claimed
US-6730930-B2 METALLIZED LAYERS, ARRANGED ONE ON TOP OF THE OTHER, WITH FIRST LINES AND SECOND LINES INTERSECTING FORMING OVERLAPPING CHANNEL INFINEON TECHNOLOGIES, AG (DE) 2004-05-04 US claimed
US-20030168675-A1 Memory element and method for fabricating a memory element POLARIS INNOVATIONS LIMITED (IE) 2003-09-11 US claimed
CN-117683009-A Polysubstituted 4H-pyran derivative and preparation method thereof 郑州铁路职业技术学院 2024-03-12 CN disclosed
CN-114177942-B Catalyst for condensation reaction of aldehyde and malononitrile Knoevenagel and preparation method thereof 兰州大学 2023-05-12 CN disclosed
CN-110590724-B 4-arylpyran derivative containing aryl urea and application thereof 陕西理工大学 2022-09-30 CN disclosed
CN-113058653-B Catalyst for Knoevenagel condensation reaction of aldehyde and malononitrile and preparation method thereof 兰州大学 2022-09-16 CN disclosed
EP-3553097-B1 COPOLYMER AND OPTICAL FILM USING SAME TOSOH CORP (JP) 2022-05-04 EP disclosed
CN-114177942-A Catalyst for Knoevenagel condensation reaction of aldehyde and malononitrile and preparation method thereof 兰州大学 2022-03-15 CN disclosed
US-11225540-B2 Copolymer and optical film using same TOSOH CORPORATION (JP) 2022-01-18 US disclosed
CN-110248971-B Copolymer and optical film using the same 东曹株式会社 2021-11-02 CN disclosed
US-5514706-A DIABETES ELI LILLY AND COMPANY (US) 1996-05-07 US disclosed
US-5434160-A Autoimmune diseases; prevention of excess cell proliferation or enzyme release LILLY INDUSTRIES LIMITED (GB) 1995-07-18 US disclosed
EP-0619314-A1 4-Phenyl-4H- naphtho(2,1-b)pyran derivatives and their pharmaceutical use ELI LILLY AND COMPANY (US) 1994-10-12 EP disclosed
EP-0599514-A2 Pyranoquinoline derivatives as inhibitors of cell proliferation LILLY INDUSTRIES LIMITED (GB) 1994-06-01 EP disclosed
US-5284868-A Naphthopyran derivatives; for autoimmune diseases, cancer ELI LILLY AND COMPANY (US) 1994-02-08 US disclosed
US-5281619-A Administering naphtho(1,2-B)pyran derivatives ELI LILLY AND COMPANY (US) 1994-01-25 US disclosed
EP-0537949-A1 Antiproliferative derivatives of 4H-naphtho 1,2-b pyran LILLY INDUSTRIES LIMITED (GB) 1993-04-21 EP disclosed
US-4184871-A A,B-UNSATURATED NITRILE SENSITIZER MITSUBISHI CHEMICAL INDUSTRIES LTD. (JP) 1980-01-22 US disclosed