SCHEMBL7355196

SCHEMBL7355196

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

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.33
SPHK1 Q9NYA1 1/20 0.33
USP2 O75604 1/20 0.33
HTT P42858 1/20 0.32
LPAR5 Q9H1C0 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 0.85 L3MBTL1 (0.38) L3MBTL1
SCHEMBL7286698 0.85 L3MBTL1 (0.38) L3MBTL1
SCHEMBL7296346 0.84 USP2 (0.49) SPHK1USP2HTTLPAR5
SCHEMBL7355201 0.84 HTT (0.37) L3MBTL1SPHK1USP2HTT
SCHEMBL7296236 0.81 LMNA (0.33) L3MBTL1
SCHEMBL7287313 0.76 USP2 (0.33) USP2HTTLPAR5
SCHEMBL2533550 0.75 ALDH1A1 (0.33) HTT
SCHEMBL2527386 0.75 ALDH1A1 (0.33) HTT
SCHEMBL18050418 0.74 L3MBTL1 (0.39) L3MBTL1
SCHEMBL18050409 0.74 L3MBTL1 (0.39) L3MBTL1

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 6 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
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