SCHEMBL2283147

SCHEMBL2283147

CCC(C)(OC(N)=O)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.48
KMT2A Q03164 1/20 0.48
CYP2C19 P33261 2/20 0.47
HIF1A Q16665 1/20 0.47
CYP1A2 P05177 2/20 0.41
CYP2D6 P10635 2/20 0.41
KCNN4 O15554 4/20 0.40
KIF11 P52732 2/20 0.40
CHRM2 P08172 2/20 0.39
CHRM1 P11229 2/20 0.39
CHRM3 P20309 2/20 0.39
CHRM4 P08173 1/20 0.39
CHRM5 P08912 1/20 0.39
TAAR1 Q96RJ0 1/20 0.38
ALDH1A1 P00352 1/20 0.38
ALOX15 P16050 1/20 0.38
HDAC3 O15379 1/20 0.38
HDAC4 P56524 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC7 Q8WUI4 1/20 0.38

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
SCHEMBL7379298 0.90 MAPT (0.43) MAPTKMT2ACYP2C19HIF1AKIF11
SCHEMBL29118559 0.86 KMT2A (0.48) MAPTKMT2ACYP2C19HIF1ACYP1A2
SCHEMBL27596019 0.86 MAPT (0.48) MAPTKMT2ACYP2C19HIF1ACYP1A2
SCHEMBL7949342 0.85 CYP2C19 (0.50) MAPTKMT2ACYP2C19HIF1ACYP1A2
SCHEMBL16028069 0.84 MAPT (0.47) MAPTKMT2ACYP2C19HIF1ACYP1A2
SCHEMBL10518614 0.84 MAPT (0.47) MAPTKMT2ACYP2C19HIF1ACYP1A2
SCHEMBL10958936 0.84 NPC1 (0.45) MAPTKMT2AKIF11ALDH1A1HTT
SCHEMBL12295974 0.84 CYP2C19 (0.48) MAPTKMT2ACYP2C19HIF1ACYP1A2
SCHEMBL5571854 0.84 CYP2C19 (0.48) MAPTKMT2ACYP2C19HIF1ACYP1A2
SCHEMBL18408916 0.84 CYP2C19 (0.48) MAPTKMT2ACYP2C19HIF1ACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7993475-B2 Firing agent for gas generating device NOF CORPORATION (JP) 2011-08-09 US disclosed
US-20100109304-A1 FIRING AGENT FOR GAS GENERATING DEVICE NOF CORPORATION (JP) 2010-05-06 US disclosed
US-20080217893-A1 Firing Agent for Gas Generating Device NOF CORPORATION (JP) 2008-09-11 US disclosed
EP-1785409-A1 FIRING AGENT FOR GAS GENERATING DEVICE NOF CORPORATION (JP) 2007-05-16 EP disclosed
US-6846373-B2 Gas-generating compositions NOF CORPORATION (JP) 2005-01-25 US disclosed
US-20020121321-A1 Gas-generating compositions NOF CORPORATION (JP) 2002-09-05 US disclosed
EP-0169650-A2 Process for preparing aromatic urethanes from nitroaromatic compounds Montedison S.p.A. (IT) 1986-01-29 EP disclosed
US-4429135-A REACTION WITH PRIMARY AMINE BAYER AKTIENGESELLSCHAFT (DE) 1984-01-31 US disclosed
EP-0044421-B1 DI- AND OLIGO-1,2,4-TRIAZOLIDINE-3,5 DIONES AND PROCESSES FOR THEIR PREPARATION BAYER AG (DE) 1983-08-24 EP disclosed
US-4386213-A CROSSLINKING POLYESTERS AND EPOXY RESINS; HEAT RESISTANCE; DIELECTRICS BAYER AKTIENGESELLSCHAFT (DE) 1983-05-31 US disclosed
EP-0030627-B1 PROCESS FOR THE PREPARATION OF 1,2,4-TRIAZOLIDIN-3,5-DIONE BAYER AG (DE) 1982-12-15 EP disclosed
US-4323687-A CYCLIZATION OF HYDRAZODICARBONAMIDE BAYER AKTIENGESELLSCHAFT (DE) 1982-04-06 US disclosed
EP-0045371-A2 Preparation of 4-substituted 1,2,4-triazolidine-3,5-diones BAYER AG (DE) 1982-02-10 EP disclosed
EP-0044421-A1 Di- and oligo-1,2,4-triazolidine-3,5 diones and processes for their preparation BAYER AG (DE) 1982-01-27 EP disclosed
EP-0030627-A1 Process for the preparation of 1,2,4-triazolidin-3,5-dione BAYER AG (DE) 1981-06-24 EP disclosed