SCHEMBL8643129

SCHEMBL8643129

NC1(N)C=CC=C([N+](=O)[O-])C1

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
SCHEMBL18037666 0.81
SCHEMBL27695099 0.81
SCHEMBL5025202 0.81
SCHEMBL30888846 0.76
SCHEMBL5378262 0.73
SCHEMBL6130810 0.73
SCHEMBL2024521 0.73
SCHEMBL27453461 0.73
SCHEMBL3869809 0.73
SCHEMBL31295612 0.71 TP53 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5750238-A Electrostatic information recording medium DAI NIPPON PRINTING CO., LTD. (JP) 1998-05-12 US disclosed
US-5721042-A EXCELLENT NEGATIVE ELECTRIC CHARGE AND PARTICULARLY POSITIVE CHARGE RETAINING CHARACTERISTICS; SUPERIOR IN HEAT AND MOISTURE RESISTANCE DAI NIPPON PRINTING CO., LTD. (JP) 1998-02-24 US disclosed
US-5527589-A ELECTRIC CHARGE RETAINING LAYER COMPRISES AN INSULATING FLUOROCARBON RESIN IN SOLID STATE AND AN INSULATING ORGANIC SUBSTANCE HAVING NO PHOTOCONDUCTIVITY DAI NIPPON PRINTING CO., LTD. (JP) 1996-06-18 US disclosed