SCHEMBL11055545

SCHEMBL11055545

NC[C@H](O)C1COc2ccccc2O1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.50
MAPT P10636 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
NISCH Q9Y2I1 1/20 0.46
ADRA1A P35348 2/20 0.45
HTR1A P08908 1/20 0.45
ADRA2A P08913 1/20 0.45
DRD1 P21728 1/20 0.45
TBXA2R P21731 1/20 0.45
SLC6A2 P23975 1/20 0.45
DRD3 P35462 1/20 0.45
KMT2A Q03164 2/20 0.45
ALDH1A1 P00352 3/20 0.43
ALOX5 P09917 1/20 0.42
POLB P06746 1/20 0.42
KDM4E B2RXH2 1/20 0.42
GAA P10253 1/20 0.42
HTT P42858 1/20 0.42
CA1 P00915 1/20 0.41

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
SCHEMBL7434736 1.00 LMNA (0.50) LMNAMAPTSMN1; SMN2NPSR1NISCH
SCHEMBL11055550 1.00 LMNA (0.50) LMNAMAPTSMN1; SMN2NPSR1NISCH
SCHEMBL11279575 1.00 LMNA (0.50) LMNAMAPTSMN1; SMN2NPSR1NISCH
Hydrochloric Acid SCHEMBL7437739 0.98 LMNA (0.49) LMNAMAPTSMN1; SMN2NPSR1NISCH
SCHEMBL7434948 0.85 LMNA (0.51) LMNAMAPTSMN1; SMN2NPSR1NISCH
SCHEMBL10805232 0.84 LMNA (0.46) LMNAMAPTSMN1; SMN2NPSR1NISCH
SCHEMBL10991807 0.83 LMNA (0.50) LMNAMAPTSMN1; SMN2NPSR1NISCH
SCHEMBL7443199 0.83 LMNA (0.50) LMNAMAPTSMN1; SMN2NPSR1NISCH
Bendacalol SCHEMBL11047717 0.82 LMNA (0.52) LMNAMAPTSMN1; SMN2NPSR1ADRA1A
Bendacalol SCHEMBL11050612 0.81 LMNA (0.51) LMNAMAPTSMN1; SMN2NPSR1ADRA1A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0050585-B1 1,5-BIS-(1,4-BENZODIOXIN-2-YL)-3-AZAPENTANE-1,5 DIOLS, PROCESS FOR THEIR PREPARATION, PHARMACEUTICAL PREPARATIONS CONTAINING THEM AND THEIR THERAPEUTICAL USE CIBA-GEIGY AG (CH) 1984-10-03 EP disclosed
US-4471127-A 1-5-Bis-(1,4-benzodioxin-2-yl)-3-azapentane-1,5-diols CIBA-GEIGY CORPORATION (US) 1984-09-11 US disclosed
US-4471128-A 1,5-Bis-(1,4-benzodioxin-2-yl)-3-azapentane-1,5-diols CIBA-GEIGY CORPORATION (US) 1984-09-11 US disclosed
US-4380653-A HYPOTENSIVES, CARDIOVASCULAR DISORDERS CIBA-GEIGY CORPORATION (US) 1983-04-19 US disclosed
US-4313955-A HYPOTESIVE AGENTS CIBA-GEIGY CORPORATION (US) 1982-02-02 US disclosed