SCHEMBL18705276

SCHEMBL18705276

[N-]=[N+]=NCCCc1[nH]nnc1[N+](=O)[O-]

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL18705278 0.91
SCHEMBL5278295 0.76 ALDH1A1 (0.36)
SCHEMBL5273229 0.69 ALDH1A1 (0.32)
SCHEMBL5280256 0.65 FBP1 (0.34)
SCHEMBL5284530 0.65 ALDH1A1 (0.32)
SCHEMBL14270201 0.63 TSHR (0.51)
SCHEMBL1244023 0.62
SCHEMBL16788835 0.61 POLB (0.40)
SCHEMBL2888790 0.60
SCHEMBL13527061 0.58 TSHR (0.50)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3359510-B1 SOLID ROCKET PROPELLANT WITH BLENDED TRIAZOLE PLASTICIZER AEROJET ROCKETDYNE INC (US) 2020-02-26 EP claimed
US-20180273439-A1 SOLID ROCKET PROPELLANT WITH BLENDED TRIAZOLE PLASTICZER AEROJET ROCKETDYNE, INC. 2018-09-27 US claimed
WO-2017062145-A1 SOLID ROCKET PROPELLANT WITH BLENDED TRIAZOLE PLASTICIZER AEROJET ROCKETDYNE, INC. (US) 2017-04-13 WO claimed
EP-3359510-B1 SOLID ROCKET PROPELLANT WITH BLENDED TRIAZOLE PLASTICIZER AEROJET ROCKETDYNE INC (US) 2020-02-26 EP disclosed
US-20180273439-A1 SOLID ROCKET PROPELLANT WITH BLENDED TRIAZOLE PLASTICZER AEROJET ROCKETDYNE, INC. 2018-09-27 US disclosed
WO-2017062145-A1 SOLID ROCKET PROPELLANT WITH BLENDED TRIAZOLE PLASTICIZER AEROJET ROCKETDYNE, INC. (US) 2017-04-13 WO disclosed