SCHEMBL6579408

SCHEMBL6579408

CNCCc1ccc(OCOCC[Si](C)(C)C)c(OC)c1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.61
POLB P06746 1/20 0.61
MAPT P10636 3/20 0.46
KMT2A Q03164 2/20 0.45
ALDH1A1 P00352 4/20 0.45
SMN1; SMN2 Q16637 2/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
LMNA P02545 2/20 0.42
KDM4E B2RXH2 1/20 0.42
GLA P06280 1/20 0.42
TSHR P16473 1/20 0.42
L3MBTL4 Q8NA19 1/20 0.42
L3MBTL3 Q96JM7 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ALOX15 P16050 1/20 0.42

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
SCHEMBL3362298 0.82 TTR (0.47) ATMPOLBMAPTKMT2AALDH1A1
SCHEMBL28917715 0.82 NPC1 (0.50) POLBMAPTKMT2AALDH1A1SMN1; SMN2
SCHEMBL30279760 0.82 NPC1 (0.50) POLBMAPTKMT2AALDH1A1SMN1; SMN2
SCHEMBL8950654 0.80 KMT2A (0.49) POLBKMT2ASMN1; SMN2LMNAKDM4E
SCHEMBL557799 0.78 ATM (1.00) ATMPOLBMAPTKMT2AALDH1A1
SCHEMBL30230461 0.78 ATM (1.00) ATMPOLBMAPTKMT2AALDH1A1
SCHEMBL8635081 0.78 ATM (1.00) ATMPOLBMAPTKMT2AALDH1A1
SCHEMBL6581703 0.78 CA5A (0.52) KMT2AALDH1A1LMNATSHRL3MBTL1
SCHEMBL13250642 0.77 POLB (0.73) ATMPOLBMAPTKMT2AALDH1A1
SCHEMBL25612190 0.77 CA12 (0.50) MAPTKMT2AALDH1A1CA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0737680-B1 (Phenylalkylaminoalkyloxyl)-hetero-aryl compounds, processes and intermediates for their preparation and medicaments containing these compounds SOLVAY PHARM GMBH (DE) 2004-03-03 EP disclosed
EP-0737680-A1 (Phenylalkylaminoalkyloxyl)-hetero-aryl compounds, processes and intermediates for their preparation and medicaments containing these compounds Kali-Chemie Pharma GmbH (DE) 1996-10-16 EP disclosed
US-5547967-A HYPOTENSIVE AGENT, ANTIISCHEMIC AGENT KALI-CHEMIE PHARMA GMBH (DE) 1996-08-20 US disclosed