SCHEMBL20398904

SCHEMBL20398904

CCCCCCCC/C=C\CCCCCCCC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SLC6A5 Q9Y345 4/20 1.00
▸ FAAH O00519 6/20 0.69
▸ CNR1 P21554 2/20 0.69
▸ CNR2 P34972 2/20 0.69
▸ EPHX2 P34913 3/20 0.52
▸ ITGB2 P05107 1/20 0.49
▸ ICAM1 P05362 1/20 0.49
▸ ITGAL P20701 1/20 0.49
▸ SLC15A2 Q16348 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL20398906 1.00 SLC6A5 (1.00) SLC6A5FAAHCNR1CNR2EPHX2
SCHEMBL26624672 1.00 SLC6A5 (1.00) SLC6A5FAAHCNR1CNR2EPHX2
SCHEMBL15649990 1.00 SLC6A5 (1.00) SLC6A5FAAHCNR1CNR2EPHX2
SCHEMBL20398918 1.00 SLC6A5 (1.00) SLC6A5FAAHCNR1CNR2EPHX2
SCHEMBL28031795 0.99 SLC6A5 (0.98) SLC6A5FAAHCNR1CNR2EPHX2
SCHEMBL26624581 0.94 SLC6A5 (0.89) SLC6A5FAAHCNR1CNR2EPHX2
SCHEMBL17204083 0.93 SLC6A5 (0.87) SLC6A5FAAHCNR1CNR2EPHX2
SCHEMBL13279669 0.93 SLC6A5 (0.87) SLC6A5FAAHCNR1CNR2EPHX2
SCHEMBL4348859 0.93 SLC6A5 (0.87) SLC6A5FAAHCNR1CNR2EPHX2
SCHEMBL22034112 0.93 SLC6A5 (0.87) SLC6A5FAAHCNR1CNR2EPHX2

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
EP-3714902-B1 STABILIZATION OF PHARMACEUTICAL COMPOSITIONS COMPRISING POLYSORBATE LEK PHARMACEUTICALS (SI) 2024-08-28 — — EP disclosed
CN-114289187-B Bauxite flotation combined collector and preparation method thereof 郑州大学 2024-01-26 — — CN disclosed
US-20230137216-A1 Stabilization of Pharmaceutical Compositions Comprising Polysorbate LEK PHARMACEUTICALS D.D. (SI) 2023-05-04 — — US disclosed
CN-114289187-A Bauxite flotation combined collecting agent and preparation method thereof 郑州大学 2022-04-08 — — CN disclosed
WO-2021180981-A1 STABILIZATION OF PHARMACEUTICAL COMPOSITIONS COMPRISING POLYSORBATE LEK PHARMACEUTICALS D.D. (SI) 2021-09-16 — — WO disclosed
EP-3714902-A1 STABILIZATION OF PHARMACEUTICAL COMPOSITIONS COMPRISING POLYSORBATE LEK Pharmaceuticals d.d. (SI) 2020-09-30 — — EP disclosed
WO-2018132876-A1 NOVEL GLYCINE TRANSPORT INHIBITORS FOR THE TREATMENT OF PAIN THE UNIVERSITY OF SYDNEY (AU) 2018-07-26 — — WO disclosed
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