SCHEMBL7299180

SCHEMBL7299180

CCN(CC)CC(O)CCCCCCCC[O]

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.58
PLA2G1B P04054 3/20 0.41
PLA2G2A P14555 1/20 0.41
GPR84 Q9NQS5 8/20 0.37
FFAR1 O14842 2/20 0.36
FFAR4 Q5NUL3 1/20 0.36
TSHR P16473 1/20 0.33
NPY1R P25929 1/20 0.33
NPY2R P49146 1/20 0.33
PSMD14 O00487 2/20 0.33
MMP2 P08253 2/20 0.33
ATG4B Q9Y4P1 2/20 0.33
HSP90AA1 P07900 1/20 0.33
RAD52 P43351 1/20 0.33
ACACB O00763 1/20 0.32
ACACA Q13085 1/20 0.32
NFKB1 P19838 1/20 0.32
ABCB1 P08183 2/20 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
SCHEMBL7297171 1.00 L3MBTL1 (0.58) L3MBTL1PLA2G1BPLA2G2AGPR84FFAR1
SCHEMBL7295993 0.98 L3MBTL1 (0.56) L3MBTL1PLA2G1BPLA2G2AGPR84FFAR1
SCHEMBL7351992 0.92 L3MBTL1 (0.53) L3MBTL1PLA2G1BPLA2G2AGPR84FFAR1
SCHEMBL3533620 0.83 PLA2G1B (0.59) L3MBTL1PLA2G1BPLA2G2AGPR84FFAR1
SCHEMBL8279073 0.83 PLA2G1B (0.59) L3MBTL1PLA2G1BPLA2G2AGPR84FFAR1
SCHEMBL25672056 0.83 PLA2G1B (0.59) L3MBTL1PLA2G1BPLA2G2AGPR84FFAR1
SCHEMBL6552313 0.83 PLA2G1B (0.59) L3MBTL1PLA2G1BPLA2G2AGPR84FFAR1
SCHEMBL3532106 0.83 PLA2G1B (0.59) L3MBTL1PLA2G1BPLA2G2AGPR84FFAR1
SCHEMBL8414666 0.83 PLA2G1B (0.59) L3MBTL1PLA2G1BPLA2G2AGPR84FFAR1
SCHEMBL7299184 0.82 L3MBTL1 (0.56) L3MBTL1PLA2G1BPLA2G2AGPR84FFAR1

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 7 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
EP-0382185-A2 Carbostyril derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1990-08-16 EP disclosed