SCHEMBL7722073

SCHEMBL7722073

CC(N=NC(C)(C(N)=NO)C1CCCCC1)(C(N)=NO)C1CCCCC1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
ALOX12 P18054 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL11316752 0.78 ALDH1A1 (0.38) MEN1ALDH1A1LMNAALOX12KMT2A
SCHEMBL11316747 0.78 ALDH1A1 (0.38) MEN1ALDH1A1LMNAALOX12KMT2A
SCHEMBL7722028 0.67 HDAC8 (0.38) MEN1ALDH1A1LMNAALOX12KMT2A
SCHEMBL18431930 0.66
SCHEMBL11528165 0.66 EPHX1 (0.31)
SCHEMBL11528167 0.66 EPHX1 (0.31)
SCHEMBL5160753 0.66 ALDH1A1 (0.42) ALDH1A1
SCHEMBL5160743 0.66 ALDH1A1 (0.42) ALDH1A1
SCHEMBL11325529 0.65 EPHX1 (0.43) MEN1ALDH1A1KMT2ASMN1; SMN2
SCHEMBL11325531 0.65 EPHX1 (0.43) MEN1ALDH1A1KMT2ASMN1; SMN2

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-6395849-B1 RADICAL INITIATORS AND NEUTRALIZATION NITTO BOSEKI CO., LTD. (JP) 2002-05-28 US disclosed