SCHEMBL5486010

SCHEMBL5486010

O=[N+]([O-])c1ccccc1C1OCCO1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.44
MAPT P10636 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
KDM4E B2RXH2 1/20 0.43
GAA P10253 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
HSD17B10 Q99714 1/20 0.42
CUL4A Q13619 1/20 0.42
TDP1 Q9NUW8 4/20 0.41
PKM P14618 1/20 0.41
DNMT3B Q9UBC3 4/20 0.40
ALDH1A1 P00352 2/20 0.40
PLAU P00749 1/20 0.40

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
SCHEMBL18555673 0.93 MEN1 (0.41) HTTMAPTMEN1KMT2AKDM4E
SCHEMBL30844063 0.83 MEN1 (0.44) HTTMAPTMEN1KMT2AKDM4E
SCHEMBL1021883 0.83 MEN1 (0.44) HTTMAPTMEN1KMT2AKDM4E
SCHEMBL30392759 0.83 TDP1 (0.41) HTTMAPTMEN1KMT2AKDM4E
SCHEMBL9354521 0.83 TDP1 (0.41) HTTMAPTMEN1KMT2AKDM4E
SCHEMBL31090476 0.83 TDP1 (0.40) HTTMAPTMEN1KMT2AKDM4E
SCHEMBL10819483 0.80 ALDH1A1 (0.43) HTTMAPTMEN1KMT2AKDM4E
SCHEMBL11451379 0.79 GPR35 (0.45) HTTMAPTMEN1KMT2AKDM4E
SCHEMBL23888701 0.77 DNMT3B (0.44) HTTMAPTMEN1KMT2AKDM4E
SCHEMBL14253769 0.77 MEN1 (0.49) MAPTMEN1KMT2AGAATDP1

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117986153-A Ionizable cationic lipid compound, and preparation method and application thereof 晟迪生物医药(苏州)有限公司 2024-05-07 CN disclosed
CN-112047871-B Preparation method of indole compound 南京大学 2022-06-21 CN disclosed
CN-112047871-A Preparation method of indole compound 南京大学 2020-12-08 CN disclosed
EP-1845083-A2 New arylsulfonohydrazide inhibitors of enzymes MurC and MurD UNIVERZA V LJUBLJANI, FAKULTETA ZA FARMACIJO (SI) 2007-10-17 EP disclosed
US-4977272-A Radiation absorbers THE STANDARD OIL COMPANY (US) 1990-12-11 US disclosed
US-4859551-A Process for preparing positive and negative images using photohardenable electrostatic master E. I. DU PONT DE NEMOURS AND COMPANY (US) 1989-08-22 US disclosed
EP-0315121-A2 Process for preparing positive and negative images using photohardenable electrostatic master E.I. DU PONT DE NEMOURS AND COMPANY (US) 1989-05-10 EP disclosed
US-4269933-A PHOTOLITHOGRAPHY; POSITIVE AND NEGATIVE IMAGES; POLYMERIZATION OF A UNSATURATED POLYESTER USING A PHOTOSENSITIVE FREE RADICAL SYSTEM E. I. DU PONT DE NEMOURS AND COMPANY (US) 1981-05-26 US disclosed
US-4198242-A Photopolymerizable composition containing an o-nitroaromatic compound as photoinhibitor E. I. DU PONT DE NEMOURS AND COMPANY (US) 1980-04-15 US disclosed
US-4131465-A Radiation sensitive polymeric o-nitrophenyl acetals and element EASTMAN KODAK COMPANY (US) 1978-12-26 US disclosed
US-4086210-A Radiation sensitive polymeric o-nitrophenyl acetals EASTMAN KODAK COMPANY (US) 1978-04-25 US disclosed