SCHEMBL28055503

SCHEMBL28055503

C=CCN1CCNC1=N[N+](=O)[O-]

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.46
CHRNA4 P43681 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL10573900 0.77 CHRNB2 (0.48) CHRNB2CHRNA4SMN1; SMN2
SCHEMBL10656625 0.77 CHRNB2 (0.43) CHRNB2CHRNA4
SCHEMBL10575446 0.77 CHRNB2 (0.43) CHRNB2CHRNA4
SCHEMBL10573894 0.77 CHRNB2 (0.48) CHRNB2CHRNA4SMN1; SMN2
SCHEMBL425614 0.77
SCHEMBL425613 0.77
SCHEMBL10573817 0.76 CHRNB2 (0.45) CHRNB2CHRNA4SMN1; SMN2
SCHEMBL10573808 0.76 CHRNB2 (0.45) CHRNB2CHRNA4SMN1; SMN2
SCHEMBL10575378 0.75 CHRNB2 (0.41) CHRNB2CHRNA4SMN1; SMN2
SCHEMBL10575381 0.75 CHRNB2 (0.41) CHRNB2CHRNA4SMN1; 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
CN-105481839-A Preparation method for cycloxylidin enantiomer with photoactivity ANHUI QIANHE NEW MAT SCIENCE & TECH DEV CO LTD 2016-04-13 CN disclosed