SCHEMBL7296236

SCHEMBL7296236

CN(C)CC(O)CCC[O]

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.33
CHRNB2 P17787 1/20 0.33
CHRNB4 P30926 1/20 0.33
CHRNA4 P43681 1/20 0.33
SLC6A2 P23975 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
DNM1 Q05193 2/20 0.32
HIF1A Q16665 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL7351174 0.91 L3MBTL1 (0.38) LMNACHRNB2CHRNB4CHRNA4SLC6A2
SCHEMBL7286698 0.91 L3MBTL1 (0.38) LMNACHRNB2CHRNB4CHRNA4SLC6A2
SCHEMBL7771271 0.85
SCHEMBL17261305 0.85 L3MBTL1 (0.36) LMNASLC6A2L3MBTL1DNM1HIF1A
SCHEMBL18050404 0.85 DNM1 (0.35) LMNASLC6A2L3MBTL1DNM1HIF1A
SCHEMBL18050418 0.82 L3MBTL1 (0.39) LMNAL3MBTL1DNM1HIF1ASMN1; SMN2
SCHEMBL18050409 0.82 L3MBTL1 (0.39) LMNAL3MBTL1DNM1HIF1ASMN1; SMN2
SCHEMBL7355196 0.81 L3MBTL1 (0.33) L3MBTL1
SCHEMBL17261304 0.79 HIF1A (0.38) LMNASLC6A2DNM1HIF1ASMN1; SMN2
SCHEMBL7454177 0.78 GPR84 (0.39) LMNADNM1HIF1ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5652247-A VASOPRESSIN ANTAGONIST OTSUKA PHARMACEUTICAL CO., LTD (JP) 1997-07-29 US disclosed
US-5436254-A Vaopressin antagonists OTSUKA PHARMACEUTICAL COMPANY, LTD. (JP) 1995-07-25 US disclosed
CN-1091288-A The oxytocin antagonist OTSUKA PHARMA CO LTD (JP) 1994-08-31 CN disclosed
EP-0602209-A1 OXYTOCIN ANTAGONIST OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-06-22 EP disclosed
EP-0382185-B1 Carbostyril derivatives OTSUKA PHARMA CO LTD (JP) 1994-06-15 EP disclosed
WO-1994001113-A1 OXYTOCIN ANTAGONIST OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1994-01-20 WO disclosed
US-5225402-A Vasopressin antagonist, vasodilation, hypotensive, diuretics and anticoagulants OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1993-07-06 US disclosed
EP-0382185-A2 Carbostyril derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1990-08-16 EP disclosed