SCHEMBL7351997

SCHEMBL7351997

CCN(CC)CC(O)CCCO

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.50
PLA2G1B P04054 3/20 0.36
PLA2G2A P14555 1/20 0.36
TSHR P16473 1/20 0.36
NPY1R P25929 1/20 0.36
NPY2R P49146 1/20 0.36
LMNA P02545 2/20 0.35
ALDH1A1 P00352 1/20 0.32
PSMD14 O00487 2/20 0.32
MMP2 P08253 2/20 0.32
ATG4B Q9Y4P1 2/20 0.32
HSP90AA1 P07900 1/20 0.32
RAD52 P43351 1/20 0.32
ACHE P22303 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
PTPN1 P18031 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
SCHEMBL7296001 0.93 L3MBTL1 (0.53) L3MBTL1PLA2G1BPLA2G2ATSHRNPY1R
SCHEMBL7297180 0.91 L3MBTL1 (0.56) L3MBTL1PLA2G1BPLA2G2ATSHRNPY1R
SCHEMBL7299184 0.91 L3MBTL1 (0.56) L3MBTL1PLA2G1BPLA2G2ATSHRNPY1R
SCHEMBL11847918 0.86 L3MBTL1 (0.44) L3MBTL1PLA2G1BPLA2G2ATSHRNPY1R
SCHEMBL8414636 0.84 L3MBTL1 (0.51) L3MBTL1PLA2G1BPLA2G2ATSHRNPY1R
SCHEMBL24180452 0.82 PLA2G1B (0.55) L3MBTL1PLA2G1BPLA2G2ALMNAPSMD14
SCHEMBL11396006 0.81 THRB (0.43) L3MBTL1PLA2G1BPLA2G2ATSHRNPY1R
SCHEMBL3533620 0.80 PLA2G1B (0.59) L3MBTL1PLA2G1BPLA2G2ALMNAPSMD14
SCHEMBL8279073 0.80 PLA2G1B (0.59) L3MBTL1PLA2G1BPLA2G2ALMNAPSMD14
SCHEMBL3532106 0.80 PLA2G1B (0.59) L3MBTL1PLA2G1BPLA2G2ALMNAPSMD14

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