SCHEMBL26564640

SCHEMBL26564640

O=C(NCC(O)O)c1ccc2c(c1)-c1ccccc1C2(F)F

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 11/20 0.54
▸ PTPRC P08575 4/20 0.42
▸ CTSL P07711 1/20 0.42
▸ PTPN13 Q12923 1/20 0.42
▸ GAA P10253 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL26577327 0.90 PDK2 (0.55) PDK2GAAKMT2AHSD17B10
SCHEMBL26573428 0.87 PDK2 (0.52) PDK2PTPRCCTSLPTPN13GAA
SCHEMBL30571717 0.83 PTPRC (0.59) PDK2PTPRCCTSLPTPN13
SCHEMBL26116640 0.83 PTPRC (0.59) PDK2PTPRCCTSLPTPN13
SCHEMBL26581011 0.82 PDK2 (0.54) PDK2PTPRCCTSLPTPN13
SCHEMBL26560867 0.80 PDK2 (0.58) PDK2PTPRCCTSLPTPN13GAA
SCHEMBL25366472 0.75 PDK2 (0.69) PDK2PTPRCGAAKMT2A
SCHEMBL30530873 0.75 PDK2 (0.69) PDK2PTPRCGAAKMT2A
SCHEMBL30572166 0.75 PTPRC (0.59) PDK2PTPRCCTSLPTPN13
SCHEMBL26115268 0.75 PTPRC (0.59) PDK2PTPRCCTSLPTPN13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023183405-A2 PHARMACEUTICAL COMPOUNDS FOR THE TREATMENT OF COMPLEMENT MEDIATED DISORDERS ALEXION PHARMACEUTICALS, INC. (US) 2023-09-28 — — WO disclosed
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