SCHEMBL7274455

SCHEMBL7274455

CCN(CC)CN(CC)[C]1CCCCC1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
GFER P55789 1/20 0.32
KMT2A Q03164 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
SCHEMBL5261086 0.83 ALDH1A1 (0.36) KDM4EMEN1ALDH1A1GFERKMT2A
SCHEMBL5259120 0.83 ALDH1A1 (0.36) KDM4EMEN1ALDH1A1GFERKMT2A
SCHEMBL1826587 0.80 KDM4E (0.33) KDM4EMEN1ALDH1A1GFERKMT2A
SCHEMBL3373140 0.71
SCHEMBL11073647 0.69 CYP2D6 (0.31) ALDH1A1
SCHEMBL3375790 0.68 CNR2 (0.33) KDM4EMEN1KMT2A
SCHEMBL3376121 0.65 SMN1; SMN2 (0.31) ALDH1A1
SCHEMBL18393768 0.65
Cyclohexane SCHEMBL8471239 0.64 ADH1C (0.32) ALDH1A1KMT2A
Cyclohexanone SCHEMBL28318157 0.64 TRIM24 (0.58) ALDH1A1KMT2A

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
EP-0367036-A2 Substituted 3-aminosydnonimines, process for their preparation and their use CASSELLA Aktiengesellschaft (DE) 1990-05-09 EP disclosed