SCHEMBL9789548

SCHEMBL9789548

O=[N+]([O-])c1[c]ccc(Cl)c1[N+](=O)[O-]

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.42
TSHR P16473 3/20 0.42
TDP1 Q9NUW8 3/20 0.35
HSD17B10 Q99714 1/20 0.35
MAPK1 P28482 1/20 0.34
GRIN2D O15399 3/20 0.33
GRIN3B O60391 3/20 0.33
GRIN1 Q05586 3/20 0.33
GRIN2A Q12879 3/20 0.33
GRIN2B Q13224 3/20 0.33
GRIN2C Q14957 3/20 0.33
GRIN3A Q8TCU5 3/20 0.33
HSPD1 P10809 1/20 0.33
HSPE1 P61604 1/20 0.33
NPC1 O15118 1/20 0.31
LMNA P02545 1/20 0.31
TP53 P04637 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
XBP1 P17861 1/20 0.31

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
SCHEMBL9528410 0.82 ALDH1A1 (0.43) ALDH1A1TSHRTDP1HSD17B10MAPK1
SCHEMBL5747020 0.82 TDP1 (0.50) ALDH1A1TSHRTDP1HSD17B10MAPK1
SCHEMBL27765771 0.78 TSHR (0.41) ALDH1A1TSHRTDP1HSD17B10MAPK1
SCHEMBL9651909 0.78 TDP1 (0.36) ALDH1A1TSHRTDP1HSD17B10MAPK1
SCHEMBL18478 0.78 TSHR (0.42) ALDH1A1TSHRTDP1HSD17B10MAPK1
SCHEMBL301080 0.76 TDP1 (0.34) ALDH1A1TDP1VCAM1CYP3A4
SCHEMBL3047388 0.76 GPR35 (0.46) ALDH1A1TSHRTDP1HSD17B10MAPK1
SCHEMBL1179476 0.73 HPGD (0.38) ALDH1A1TSHRTDP1HSD17B10MAPK1
SCHEMBL10731966 0.73 ALDH1A1 (0.39) ALDH1A1TSHRTDP1TP53MAPT
SCHEMBL11736332 0.73 HSPD1 (0.38) ALDH1A1TSHRTDP1MAPK1HSPD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5055509-A Mixing with aryl phosphoryl azide, heating ALLIED-SIGNAL INC. (US) 1991-10-08 US disclosed
EP-0442934-A1 A METHOD OF BLOOW MOLDING POLYAMIDES AlliedSignal Inc. (US) 1991-08-28 EP disclosed
US-5041497-A Process for preparing co-poly(amides/peptides) ALLIED-SIGNAL INC. (US) 1991-08-20 US disclosed
WO-1990012052-A2 A PROCESS FOR PREPARING CO-POLY(AMIDES/PEPTIDES) ALLIED-SIGNAL INC. (US) 1990-10-18 WO disclosed
US-4946909-A Process for production of quasi-random copolymers from homopolymers using aryl phosphoryl azide(s) ALLIED-SIGNAL INC. (US) 1990-08-07 US disclosed
WO-1990005163-A1 A METHOD OF BLOOW MOLDING POLYAMIDES ALLIED-SIGNAL INC. (US) 1990-05-17 WO disclosed
US-4906708-A Process for increasing the melt viscosity and/or melt elasticity of polyamides with aryl phosphoryl azide ALLIED-SIGNAL INC. (US) 1990-03-06 US disclosed
US-4876127-A ARYL PHOSPHORYL AZIDE ALLIED-SIGNAL INC. (US) 1989-10-24 US disclosed
US-4482655-A SUBSTITUTED SUCCINIC ANHYDRIDE COUPLER MILLIKEN RESEARCH CORPORATION (US) 1984-11-13 US disclosed
US-4328041-A TREATED WITH SUBSTITUTED SUCCINIC ANHYDRIDE MILLIKEN RESEARCH CORPORATION (US) 1982-05-04 US disclosed
US-4192792-A Atactic polypropylene KENRICH PETROCHEMICALS, INC. (US) 1980-03-11 US disclosed
EP-0007748-A1 Composition containing atactic polypropylene and a filler treated with an organo-titanate chelate KENRICH PETROCHEMICALS, INC. (US) 1980-02-06 EP disclosed
US-4122062-A FILLERS KENRICH PETROCHEMICALS, INC. (US) 1978-10-24 US disclosed
US-4098758-A ORGANIC ACIDS, FOR USE IN POLYMER SYSTEMS KENRICH PETROCHEMICALS, INC. (US) 1978-07-04 US disclosed
US-4096110-A Filled polyesters containing organic titanate esters KENRICH PETROCHEMICALS, INC. (US) 1978-06-20 US disclosed
US-4094853-A Alkoxy titanate salts useful as coupling agents KENRICH PETROCHEMICALS, INC. (US) 1978-06-13 US disclosed
US-4087402-A USED FOR TREATMENT OF INORGANIC FILLERS KENRICH PETROCHEMICALS, INC. (US) 1978-05-02 US disclosed
US-4069192-A ORGANIC KENRICH PETROCHEMICALS, INC. (US) 1978-01-17 US disclosed