SCHEMBL11243719

SCHEMBL11243719

CC(C)(C)C(=NO)n1cnc([N+](=O)[O-])c1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.35
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
HTR2B P41595 1/20 0.34
ALDH1A1 P00352 2/20 0.33
KMT2A Q03164 1/20 0.33
PKM P14618 1/20 0.32
TAAR1 Q96RJ0 1/20 0.32

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
SCHEMBL11243718 1.00 L3MBTL1 (0.35) L3MBTL1HTR2AHTR2CHTR2BALDH1A1
SCHEMBL13102445 0.74 L3MBTL1 (0.42) L3MBTL1HTR2AHTR2CHTR2BALDH1A1
SCHEMBL22616127 0.73 L3MBTL1 (0.41) L3MBTL1HTR2AHTR2CHTR2BALDH1A1
SCHEMBL11244708 0.72 L3MBTL1 (0.49) L3MBTL1ALDH1A1KMT2APKMTAAR1
SCHEMBL11244694 0.72 L3MBTL1 (0.49) L3MBTL1ALDH1A1KMT2APKMTAAR1
SCHEMBL11262213 0.70 L3MBTL1 (0.33) L3MBTL1HTR2AHTR2CHTR2BALDH1A1
SCHEMBL11262224 0.70 L3MBTL1 (0.33) L3MBTL1HTR2AHTR2CHTR2BALDH1A1
SCHEMBL11240765 0.69 KDM4E (0.37) L3MBTL1ALDH1A1KMT2A
SCHEMBL11240770 0.69 KDM4E (0.37) L3MBTL1ALDH1A1KMT2A
SCHEMBL13684172 0.68 ALDH1A1 (0.40) L3MBTL1HTR2AHTR2CHTR2BALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4359469-A Combating pests with N-sulphenylated oxime-carbamates BAYER AKTIENGESELLSCHAFT (DE) 1982-11-16 US disclosed