SCHEMBL28829705

SCHEMBL28829705

CCCCN1C=CN(C)C1.CCN1C=CN(C)C1.COS(=O)(=O)O

nearest known ligand 0.30

Known targets — ChEMBL curated mechanism

ACHECHRM1CHRM3

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GLB1 P16278 1/20 0.30

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
SCHEMBL563648 0.95 GLB1 (0.33) GLB1
SCHEMBL31241428 0.92 GLB1 (0.33) GLB1
SCHEMBL563226 0.91
SCHEMBL27670295 0.90 GUSB (0.36)
SCHEMBL27689123 0.90 GUSB (0.36)
SCHEMBL5572979 0.90 GUSB (0.36)
SCHEMBL27980246 0.90 GUSB (0.36)
SCHEMBL27689140 0.90 GUSB (0.36)
SCHEMBL28159521 0.87 CA1 (0.30)
SCHEMBL27657222 0.86 GLB1 (0.33) GLB1

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-105793363-A Conductive compositions and layers made therefrom 索尔维公司 2016-07-20 CN disclosed