SCHEMBL10721925

SCHEMBL10721925

CC1(N)CCCN1C1CCCCCC1

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.33
BDKRB2 P30411 1/20 0.33
HSD11B1 P28845 1/20 0.32
PARP1 P09874 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
SCHEMBL10723845 1.00 SIGMAR1 (0.33) SIGMAR1BDKRB2HSD11B1PARP1
SCHEMBL10723908 0.98 BDKRB2 (0.31) SIGMAR1BDKRB2PARP1
SCHEMBL20390137 0.94 BDKRB2 (0.33) SIGMAR1BDKRB2HSD11B1
SCHEMBL10725073 0.91
SCHEMBL10943620 0.76 SIGMAR1 (0.32) SIGMAR1HSD11B1
SCHEMBL10563453 0.75 BDKRB2 (0.31) SIGMAR1BDKRB2
SCHEMBL19987632 0.72 SIGMAR1 (0.34) SIGMAR1BDKRB2HSD11B1
SCHEMBL10858558 0.70 SIGMAR1 (0.32) SIGMAR1HSD11B1
SCHEMBL11568926 0.69 BDKRB2 (0.33) SIGMAR1BDKRB2HSD11B1
SCHEMBL22877326 0.68 SIGMAR1 (0.42) SIGMAR1

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-4673686-A CNS MODIFIERS, ANTI-APOMORPHINE ANTIENETIC ACITIVTY/ SOCIETE D'ETUDES SCIENTIFIQUES ET INDUSTRIELLE DE L'ILE DE FRANCE (FR) 1987-06-16 US disclosed