SCHEMBL9499566

SCHEMBL9499566

CCc1c(CC)c(C(P(=O)(O)O)P(=O)(O)O)c(CC)c(CC)c1C(P(=O)(O)O)P(=O)(O)O

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ FDPS P14324 8/20 0.38
▸ LAP3 P28838 2/20 0.37
▸ SRC P12931 1/20 0.34
▸ METAP1 P53582 2/20 0.32
▸ PGK1 P00558 1/20 0.31
▸ PGK2 P07205 1/20 0.31
▸ LPAR3 Q9UBY5 3/20 0.31
▸ LPAR2 Q9HBW0 1/20 0.31

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
SCHEMBL6519625 0.69 PGK1 (0.48) FDPSLAP3PGK1PGK2LPAR3
SCHEMBL11452448 0.69 PGK1 (0.48) FDPSLAP3PGK1PGK2LPAR3
SCHEMBL15419482 0.65 SRC (0.39) SRCPGK1PGK2
SCHEMBL35435 0.61 — —
SCHEMBL27766663 0.61 KDM4E (0.61) FDPSLAP3METAP1LPAR3LPAR2
Phosphoric Acid SCHEMBL27724132 0.60 — —
SCHEMBL11320696 0.60 PGK1 (0.62) PGK1PGK2
SCHEMBL17626554 0.58 KDM4E (0.57) FDPSLAP3METAP1LPAR3LPAR2
Hydrochloric Acid SCHEMBL3955402 0.58 KDM4E (0.57) FDPSLAP3METAP1LPAR3LPAR2
SCHEMBL8923361 0.58 KDM4E (0.57) FDPSLAP3METAP1LPAR3LPAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2823304-B1 SANDWICH ASSAY FOR IMMUNOSUPPRESSANT DRUGS SIEMENS HEALTHCARE DIAGNOSTICS INC (US) 2018-03-14 — — EP disclosed
EP-2823304-A1 SANDWICH ASSAY FOR IMMUNOSUPPRESSANT DRUGS Siemens Healthcare Diagnostics Inc. (US) 2015-01-14 — — EP disclosed
US-8586322-B2 Sandwich assay for immunosuppressant drugs Siemens Healthcare Diagnostics, Inc (US) 2013-11-19 — — US disclosed
US-20130236918-A1 SANDWICH ASSAY FOR IMMUNOSUPPRESSANT DRUGS SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2013-09-12 — — US disclosed
WO-2013133917-A1 SANDWICH ASSAY FOR IMMUNOSUPPRESSANT DRUGS SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2013-09-12 — — WO disclosed
US-5185419-A POLY(ARYLENEVINYLENESILOXANES) COMPOUNDS CONSORTIUM FUR ELEKTROCHEMISCHE GMBH (DE) 1993-02-09 — — US disclosed
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