SCHEMBL7795517

SCHEMBL7795517

CCCCCC(N)C(=O)OP(=O)(O)O

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ LAP3 P28838 2/20 0.52
▸ SMPD1 P17405 3/20 0.49
▸ S1PR2 O95136 7/20 0.46
▸ S1PR1 P21453 7/20 0.46
▸ S1PR3 Q99500 7/20 0.46
▸ S1PR4 O95977 4/20 0.46
▸ FDPS P14324 4/20 0.46
▸ S1PR5 Q9H228 1/20 0.44
▸ GRIK1 P39086 1/20 0.42
▸ SLC1A2 P43004 1/20 0.42
▸ SLC1A1 P43005 1/20 0.42
▸ GRIK2 Q13002 1/20 0.42
▸ DPP7 Q9UHL4 1/20 0.42

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
SCHEMBL22092197 0.84 GSR (0.52) DPP7
SCHEMBL874554 0.84 GSR (0.52) DPP7
SCHEMBL1666692 0.82 GSR (0.50) DPP7
SCHEMBL5444478 0.82 GSR (0.50) DPP7
Fluoride SCHEMBL11671041 0.82 GSR (0.50) DPP7
SCHEMBL27731459 0.82 GSR (0.50) DPP7
SCHEMBL11801571 0.82 GSR (0.50) DPP7
SCHEMBL8919007 0.81 GSR (0.44) DPP7
SCHEMBL7795355 0.80 LPAR5 (0.51) S1PR2S1PR1S1PR3S1PR5
SCHEMBL27579516 0.80 LPAR5 (0.51) S1PR2S1PR1S1PR3S1PR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1086291-C The primary and secondary neuroprotective effect of flupirtine in neurodegenerative diseases ASTA MEDICA AG (DE) 2002-06-19 — — CN disclosed
EP-0716602-B1 THE PRIMARY AND SECONDARY NEUROPROTECTIVE EFFECT OF FLUPIRTINE IN NEURODEGENERATIVE DISEASES ASTA MEDICA AG (DE) 2001-12-12 — — EP disclosed
CN-1129399-A Primary and secondary neuroprotective effects of flupirtine in neurodegenerative diseases ASTA MEDICA AG (DE) 1996-08-21 — — CN disclosed
EP-0716602-A1 THE PRIMARY AND SECONDARY NEUROPROTECTIVE EFFECT OF FLUPIRTINE IN NEURODEGENERATIVE DISEASES ASTA Medica Aktiengesellschaft (DE) 1996-06-19 — — EP disclosed
WO-1995005175-A1 THE PRIMARY AND SECONDARY NEUROPROTECTIVE EFFECT OF FLUPIRTINE IN NEURODEGENERATIVE DISEASES ASTA MEDICA AKTIENGESELLSCHAFT (DE) 1995-02-23 — — WO disclosed
Send feedback