SCHEMBL8186969

SCHEMBL8186969

CCCN1CCN(C2CNC2)CC1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 7/20 0.36
SIGMAR1 Q99720 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
ALDH1A1 P00352 1/20 0.35
SLC6A4 P31645 2/20 0.33
GNAI3 P08754 3/20 0.33
GNAO1 P09471 3/20 0.33
GNAI1 P63096 3/20 0.33

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
SCHEMBL639711 0.85 HTR6 (0.43) DRD2SMN1; SMN2ALDH1A1GNAI3GNAO1
SCHEMBL639712 0.85 HTR6 (0.43) DRD2SMN1; SMN2ALDH1A1GNAI3GNAO1
SCHEMBL16203227 0.83 KMT2A (0.38) SMN1; SMN2ALDH1A1
SCHEMBL23135123 0.80 SMN1; SMN2 (0.45) DRD2SIGMAR1SMN1; SMN2ALDH1A1SLC6A4
SCHEMBL1482275 0.80 GNAO1 (0.45) DRD2SIGMAR1SMN1; SMN2ALDH1A1GNAI3
SCHEMBL26972525 0.80 HTR6 (0.42) DRD2SMN1; SMN2
SCHEMBL3957401 0.79 KDM4E (0.42) ALDH1A1
Hydrochloric Acid SCHEMBL1795218 0.79 GNAO1 (0.47) DRD2SMN1; SMN2ALDH1A1GNAI3GNAO1
SCHEMBL24745760 0.77 SMN1; SMN2 (0.39) DRD2SIGMAR1SMN1; SMN2ALDH1A1SLC6A4
SCHEMBL23023308 0.76

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
WO-2000063168-A1 SYNTHESIS OF AZETIDINE DERIVATIVES COELACANTH CHEMICAL CORPORATION (US) 2000-10-26 WO disclosed