SCHEMBL23486162

SCHEMBL23486162

O=C(Nc1cc(Cl)ccc1-c1nnn[nH]1)C(=O)NC(Cc1ccccc1)C(=O)Nc1ccc(C(=O)O)cc1

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 1/20 0.42
F11 P03951 17/20 0.42
KLKB1 P03952 10/20 0.42
F9 P00740 1/20 0.41
KLK1 P06870 2/20 0.40

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
SCHEMBL23486163 1.00 S1PR1 (0.42) S1PR1F11KLKB1F9KLK1
SCHEMBL23486855 0.90 MAPT (0.40) S1PR1F11KLKB1
SCHEMBL30680266 0.90 MAPT (0.40) S1PR1F11KLKB1
SCHEMBL23486170 0.90 MAPT (0.40) S1PR1F11KLKB1
SCHEMBL30680299 0.87 MEN1 (0.41)
SCHEMBL29758118 0.86 F11 (0.52) S1PR1F11KLKB1F9KLK1
SCHEMBL23466397 0.86 F11 (0.52) S1PR1F11KLKB1F9KLK1
SCHEMBL23466398 0.86 F11 (0.52) S1PR1F11KLKB1F9KLK1
SCHEMBL3634248 0.84 F11 (0.57) F11KLKB1
SCHEMBL23486171 0.81 CAPN1 (0.39)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114728917-B Oxamide derivative, preparation method and medical application thereof 深圳信立泰药业股份有限公司 2023-12-08 CN disclosed
CN-114728917-A Oxamide derivative, preparation method and medical application thereof 深圳信立泰药业股份有限公司 2022-07-08 CN disclosed
WO-2021110076-A1 OXAMIDE DERIVATIVES, PREPARATION METHOD THEREFOR AND USE THEREOF IN MEDICINE 深圳信立泰药业股份有限公司 2021-06-10 WO disclosed