SCHEMBL998545

SCHEMBL998545

O=C=NC1=CCC(N=C=O)C=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
SCHEMBL328287 0.77
SCHEMBL14304556 0.76
SCHEMBL1705095 0.70
SCHEMBL14685067 0.70 CYP3A4 (0.50)
SCHEMBL12673819 0.70 CYP3A4 (0.50)
SCHEMBL14267888 0.69
SCHEMBL28115854 0.68
SCHEMBL19958532 0.68
SCHEMBL13336190 0.68
SCHEMBL14400231 0.68

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3415332-B1 INK JET RECORDING METHOD FUJIFILM CORP (JP) 2021-09-22 EP disclosed
WO-2020215424-A1 POLYCARBONATE, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 武汉华星光电半导体显示技术有限公司 2020-10-29 WO disclosed
EP-2454306-A1 POLYCARBONATES HAVING A SCRATCH-RESISTANT COATING AND HAVING HIGH TRANSPARENCY, METHOD FOR THE PRODUCTION THEREOF, AND USE THEREOF BASF Coatings GmbH (DE) 2012-05-23 EP disclosed
WO-2011006552-A1 POLYCARBONATES HAVING A SCRATCH-RESISTANT COATING AND HAVING HIGH TRANSPARENCY, METHOD FOR THE PRODUCTION THEREOF, AND USE THEREOF BASF COATINGS GMBH (DE) 2011-01-20 WO disclosed