SCHEMBL5604304

SCHEMBL5604304

O=[N+]([O-])c1[c]ccc2cc[c]c([N+](=O)[O-])c12

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.31
ALDH1A1 P00352 2/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
KDM4E B2RXH2 1/20 0.31
NPC1 O15118 1/20 0.31
MITF O75030 1/20 0.31
MAPT P10636 1/20 0.31
XBP1 P17861 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
TSHR P16473 1/20 0.30
POLB P06746 1/20 0.30
CACNA1B Q00975 1/20 0.30
APBA1 Q02410 1/20 0.30
ATM Q13315 1/20 0.30
RXFP1 Q9HBX9 1/20 0.30

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
SCHEMBL644469 0.77 ALDH1A1 (0.52) LMNAALDH1A1MEN1KMT2ATDP1
SCHEMBL3277949 0.75 LMNA (0.33) LMNAALDH1A1MEN1KMT2ATDP1
SCHEMBL5035468 0.70 ALDH1A1 (0.35) LMNAALDH1A1MEN1KMT2AMAPT
SCHEMBL18478 0.70 TSHR (0.42) ALDH1A1MEN1KMT2AMAPTTDP1
SCHEMBL457836 0.70 TSHR (0.44) ALDH1A1MAPTSMN1; SMN2TDP1TSHR
SCHEMBL5747020 0.70 TDP1 (0.50) ALDH1A1TDP1TSHR
SCHEMBL6208168 0.70 GPR35 (0.39) ALDH1A1MEN1KMT2AKDM4EMAPT
SCHEMBL7646276 0.69 ABCC8 (0.36) ALDH1A1TDP1
SCHEMBL9789548 0.68 ALDH1A1 (0.42) LMNAALDH1A1NPC1MAPTXBP1
SCHEMBL6676890 0.68 GPR35 (0.52) ALDH1A1MEN1KMT2AKDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0694532-B1 Perfluoroalkyl sulfide, sulfone, polysulfone and polysulfide diols CIBA SC HOLDING AG (CH) 2000-05-31 EP claimed
CN-102317235-B The composition and method of greasiness removal and pollution resistance are provided for substrate 3M创新有限公司 2017-10-31 CN disclosed
US-7297279-B2 Method for removing oil from water coalescing in a polymer particle/fiber media AMCOL INTERNATIONAL CORPORATION (US) 2007-11-20 US disclosed
CN-1993439-A Adhesive delivery of fluoroether repellents 3M INNOVATIVE PROPERTIES CO (US) 2007-07-04 CN disclosed
US-20060163177-A1 Method for removing oil from water coalescing in a polymer particle/fiber media AMCOL INTERNATIONAL CORPORATION (US) 2006-07-27 US disclosed
EP-0455587-B1 New polymers and hard gas-permeable contact lenses made therefrom CIBA GEIGY AG (CH) 1995-07-19 EP disclosed
US-5264878-A Polymers and hard, gas-permeable contact lenses made therefrom CIBA-GEIGY CORPORATION (US) 1993-11-23 US disclosed
US-5196493-A Siloxane monvinyl and oligonvinyl components with fluoroacrylate and hydrophobic vinyl component having bulky hydrocarbon radical CIBA-GEIGY CORPORATION (US) 1993-03-23 US disclosed
EP-0455587-A1 New polymers and hard gas-permeable contact lenses made therefrom CIBA-GEIGY AG (CH) 1991-11-06 EP disclosed
EP-0000507-B1 PROCESS FOR THE PRODUCTION OF HYDROGELS IN THE FORM OF SPHERICALLY SHAPED BEADS WITH LARGER DIAMETERS CIBA-GEIGY AG (CH) 1982-09-29 EP disclosed
US-4304591-A A HIGH-STRENGTH GEL OF MALEIMIDE-MODIFIED POLYOXYPROPYLENE OR -TETRAMETHYLENE GLYCOL CROSSLINKED BY A WATER-SOLUBLE OLEFIN; SUSTAINED RELEASE CIBA-GEIGY CORPORATION (US) 1981-12-08 US disclosed
US-4277582-A MEMBRANES AND CARRIERS FOR SUSTAINED RELEASE CIBA-GEIGY CORPORATION (US) 1981-07-07 US disclosed
US-4224427-A HYDROPHILIC MONOMER, POLYOLEFINIC MACROMER CROSSLINKER, METAL HYDROXIDE GEL CIBA-GEIGY CORPORATION (US) 1980-09-23 US disclosed
US-4192827-A IN A DELAMINATED MATRIX OF A TRANSITITION METAL DICHALCOGENIDE CIBA-GEIGY CORPORATION (US) 1980-03-11 US disclosed
US-4177056-A CROSSLINKED; SUSTAINED RELEASE CIBA-GEIGY CORPORATION (US) 1979-12-04 US disclosed
EP-0000507-A1 Process for the production of hydrogels in the form of spherically shaped beads with larger diameters CIBA-GEIGY AG (CH) 1979-02-07 EP disclosed
US-4136250-A CROSSLINKED, ADDITION MONOMER OR POLYMER CIBA-GEIGY CORPORATION (US) 1979-01-23 US disclosed