SCHEMBL7768583

SCHEMBL7768583

CCCCOP(=O)(OCCCC)Oc1cccc(OP(=O)(OCCCC)OCCCC)c1

nearest known ligand 0.82

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.53

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
SCHEMBL25284051 0.91 CYP3A4 (0.47) CYP3A4
SCHEMBL7772922 0.89 KMT2A (0.46)
SCHEMBL3234331 0.89 CYP3A4 (0.46) CYP3A4
SCHEMBL27042296 0.89 KMT2A (0.50) CYP3A4
SCHEMBL3229774 0.89 CYP3A4 (0.46) CYP3A4
SCHEMBL19904729 0.89 TSHR (0.55) CYP3A4
SCHEMBL124571 0.88 CYP3A4 (0.55) CYP3A4
SCHEMBL31169485 0.87 CYP3A4 (0.47) CYP3A4
SCHEMBL16023560 0.87 KMT2A (0.58)
Triphenyl Phosphate SCHEMBL7526391 0.86 CYP3A4 (0.53) CYP3A4

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
WO-2016116603-A1 NOVEL PHENYLPHOSPHATES AND USE THEREOF AS MEDICAMENTS UNIVERSITÄT LEIPZIG (DE) 2016-07-28 WO disclosed
EP-1112313-A1 HALOGEN-FREE FLAME RETARDANT THERMOPLASTIC POLYMER COMPOSITIONS ALBEMARLE CORPORATION (US) 2001-07-04 EP disclosed
WO-2000017268-A1 HALOGEN-FREE FLAME RETARDANT THERMOPLASTIC POLYMER COMPOSITIONS ALBEMARLE CORPORATION (US) 2000-03-30 WO disclosed