SCHEMBL15399539

SCHEMBL15399539

NC1(F)C=CC([N+](=O)[O-])=CC1

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
SCHEMBL7918141 0.78
SCHEMBL9763476 0.78 CYP19A1 (0.30)
SCHEMBL7759919 0.78
SCHEMBL4754696 0.78
SCHEMBL4953742 0.78
SCHEMBL23357784 0.78
SCHEMBL8813249 0.78
SCHEMBL9711596 0.78
SCHEMBL10659257 0.74 HTT (0.30)
SCHEMBL3953753 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119143610-A Method for continuously and efficiently synthesizing N-methyl paranitroaniline 中国兵器工业火炸药工程与安全技术研究院 2024-12-17 CN claimed
CN-119143610-B Method for continuously and efficiently synthesizing N-methyl paranitroaniline 中国兵器工业火炸药工程与安全技术研究院 2025-08-15 CN disclosed
CN-119143610-A Method for continuously and efficiently synthesizing N-methyl paranitroaniline 中国兵器工业火炸药工程与安全技术研究院 2024-12-17 CN disclosed
EP-2867238-B1 PHENYL AMINO PYRIMIDINE BICYCLIC COMPOUNDS AND USES THEREOF YM BIOSCIENCES AUSTRALIA PTY (AU) 2017-08-09 EP disclosed
EP-2867238-A1 PHENYL AMINO PYRIMIDINE BICYCLIC COMPOUNDS AND USES THEREOF YM BioSciences Australia Pty Ltd (AU) 2015-05-06 EP disclosed
US-8809359-B2 Phenyl amino pyrimidine bicyclic compounds and uses thereof YM BIOSCIENCES AUSTRALIA PTY LTD (US) 2014-08-19 US disclosed
WO-2014000032-A1 PHENYL AMINO PYRIMIDINE BICYCLIC COMPOUNDS AND USES THEREOF YM BIOSCIENCES AUSTRALIA PTY LTD (AU) 2014-01-03 WO disclosed
US-20140005161-A1 PHENYL AMINO PYRIMIDINE BICYCLIC COMPOUNDS AND USES THEREOF YM BIOSCIENCES AUSTRALIA PTY LTD (US) 2014-01-02 US disclosed