SCHEMBL20694580

SCHEMBL20694580

CCCCC(=O)N(Cc1ccc(-c2ccccc2/C(N)=N/NN)cc1)C(C(=O)O)C(C)C

nearest known ligand 0.60

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LTB4R2 Q9NPC1 14/20 0.60
AGTR1 P30556 8/20 0.59
ABCB11 O95342 1/20 0.59
GP6 Q9HCN6 1/20 0.59

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
SCHEMBL21097873 0.90 LTB4R2 (0.54) LTB4R2AGTR1ABCB11GP6
SCHEMBL21098339 0.90 LTB4R2 (0.54) LTB4R2AGTR1ABCB11GP6
SCHEMBL19236573 0.88 LTB4R2 (0.60) LTB4R2AGTR1ABCB11GP6
SCHEMBL21098639 0.87 LTB4R2 (0.56) LTB4R2AGTR1ABCB11GP6
SCHEMBL25964113 0.86 LTB4R2 (0.66) LTB4R2AGTR1ABCB11GP6
SCHEMBL2364 0.86 LTB4R2 (0.80) LTB4R2AGTR1ABCB11GP6
SCHEMBL2365 0.86 LTB4R2 (0.80) LTB4R2AGTR1ABCB11GP6
SCHEMBL18406103 0.86 LTB4R2 (0.60) LTB4R2AGTR1ABCB11GP6
SCHEMBL19342800 0.85 LTB4R2 (0.63) LTB4R2AGTR1ABCB11GP6
SCHEMBL17946059 0.85 LTB4R2 (0.69) LTB4R2AGTR1ABCB11GP6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021221521-A1 A SOLID CO-AMORPHOUS DISPERSION OF VALSARTAN, A METHOD FOR SYNTHETIZING THE SAME AND A MEDICAL USE OF THE DISPERSION UNIWERSYTET HUMANISTYCZNO-PRZYRODNICZY IM JANA DLUGOSZA W CZESTOCHOWIE (PL) 2021-11-04 WO disclosed
EP-3658122-B1 PHARMACEUTICAL COMPOSITION COMPRISING SACUBITRIL AND VALSARTAN SYNTHON BV (NL) 2021-04-07 EP disclosed
EP-3250565-B1 TETRAZOLONES AS CARBOXYLIC ACID BIOISOSTERES RIGEL PHARMACEUTICALS INC (US) 2019-07-03 EP disclosed
WO-2019020706-A1 PHARMACEUTICAL COMPOSITION COMPRISING SACUBITRIL AND VALSARTAN SYNTHON B.V. (NL) 2019-01-31 WO disclosed