SCHEMBL17319478

SCHEMBL17319478

CCCCCCCCCCCCCCCCCCCCOCC(COP(C)(=O)OCC[N+](C)(C)F)OCCCCC(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RECQL P46063 1/20 0.54
▸ LPAR1 Q92633 4/20 0.52
▸ LPAR3 Q9UBY5 4/20 0.52
▸ LPAR2 Q9HBW0 1/20 0.46
▸ ADRA1D P25100 1/20 0.44
▸ PTAFR P25105 1/20 0.44
▸ HTR1D P28221 1/20 0.44
▸ HTR2C P28335 1/20 0.44
▸ ADRA1B P35368 1/20 0.44
▸ DRD3 P35462 1/20 0.44
▸ TMEM97 Q5BJF2 1/20 0.44
▸ ALDH1A1 P00352 2/20 0.43
▸ PRKD3 O94806 1/20 0.43
▸ PRKCG P05129 1/20 0.43
▸ PRKCB P05771 1/20 0.43
▸ PRKCA P17252 1/20 0.43
▸ PRKCH P24723 1/20 0.43
▸ AKT1 P31749 1/20 0.43
▸ PRKCI P41743 1/20 0.43
▸ PRKCE Q02156 1/20 0.43

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
SCHEMBL15166531 0.92 RECQL (0.64) RECQLLPAR1LPAR3LPAR2ADRA1D
SCHEMBL12345714 0.90 LPAR1 (0.55) RECQLLPAR1LPAR3LPAR2ADRA1D
SCHEMBL15166533 0.85 LPAR1 (0.56) RECQLLPAR1LPAR3LPAR2
SCHEMBL12582038 0.83 LPAR1 (0.54) RECQLLPAR1LPAR3LPAR2
Vb-201 SCHEMBL19327154 0.81 RECQL (0.64) RECQLLPAR1LPAR3LPAR2ADRA1D
Vb-201 SCHEMBL15942776 0.81 RECQL (0.64) RECQLLPAR1LPAR3LPAR2ADRA1D
SCHEMBL8746968 0.81 RECQL (0.64) RECQLLPAR1LPAR3LPAR2ADRA1D
SCHEMBL12345691 0.81 RECQL (0.64) RECQLLPAR1LPAR3LPAR2ADRA1D
SCHEMBL15164286 0.81 RECQL (0.64) RECQLLPAR1LPAR3LPAR2ADRA1D
SCHEMBL27966578 0.81 RECQL (0.64) RECQLLPAR1LPAR3LPAR2ADRA1D

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
US-9206206-B2 Oxidized lipid compounds and uses thereof VASCULAR BIOGENICS LTD. (IL) 2015-12-08 — — US disclosed
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