SCHEMBL5995294

SCHEMBL5995294

COc1ccc(C(=O)C(C)[P](=O)C(=O)c2c(C)cc(C)cc2C)c(OC)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.44
PDE4A P27815 1/20 0.44
PDE4B Q07343 1/20 0.44
PDE4C Q08493 1/20 0.44
PDE4D Q08499 1/20 0.44
NPC1 O15118 4/20 0.44
ABCG2 Q9UNQ0 4/20 0.43
MAPT P10636 4/20 0.42
TNFRSF1A P19438 1/20 0.42
RAB9A P51151 3/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
MITF O75030 1/20 0.40
GAA P10253 1/20 0.40
XDH P47989 1/20 0.40
HIF1A Q16665 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40
RAD52 P43351 1/20 0.40
LMNA P02545 2/20 0.39

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
SCHEMBL5994253 0.90 MAPT (0.46) TP53PDE4APDE4BPDE4CPDE4D
SCHEMBL5996138 0.90 PDE4A (0.42) TP53PDE4APDE4BPDE4CPDE4D
SCHEMBL6824914 0.87 PDE4A (0.48) TP53PDE4APDE4BPDE4CPDE4D
SCHEMBL5994823 0.85 MAPT (0.47) TP53PDE4APDE4BPDE4CPDE4D
SCHEMBL6397140 0.85 CYP3A4 (0.40) TP53ABCG2MAPTKMT2AMEN1
SCHEMBL5995330 0.82 CYP3A4 (0.40) TP53ABCG2MAPTKMT2AMEN1
SCHEMBL6395993 0.82 ALDH1A1 (0.38) ABCG2KMT2AGAAALDH1A1HPGD
SCHEMBL5997093 0.79 CA12 (0.41) MAPTKMT2AMEN1GAACYP1A2
SCHEMBL9726493 0.77 NPC1 (0.62) TP53PDE4APDE4BPDE4CPDE4D
SCHEMBL19180233 0.77 NPC1 (0.43) TP53NPC1ABCG2MAPTTNFRSF1A

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
US-7026017-B2 Photoinitiators for acrylic esters; reacting an acyl halide with a metal benzoyl phosphine; cable coatings, screen printing stencils, resist materials, colour filters, electrical encapsulation CIBA SPECIALTY CHEMICALS CORPORATION (US) 2006-04-11 US disclosed
US-6969733-B2 Photoinitiators CIBA SPECIALTY CHEMICALS CORPORATION (US) 2005-11-29 US disclosed
US-6737549-B2 PHOTOINITIATORS FOR ACRYLATE COATINGS CIBA SPECIALTY CHEMICALS CORPORATION 2004-05-18 US disclosed
US-20030139485-A1 Photoinitiators WOLF JEAN-PIERRE (CH) 2003-07-24 US disclosed
US-20030130370-A1 Photoinitiators for acrylic esters; reacting an acyl halide with a metal benzoyl phosphine; cable coatings, screen printing stencils, resist materials, colour filters, electrical encapsulation WOLF JEAN-PIERRE (CH) 2003-07-10 US disclosed
US-20020026049-A1 Photoinitiators for acrylate coatings CIBA SPECIALTY CHEMICALS CORP. 2002-02-28 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030139485-A1 Photoinitiators DHCR24, NR1I3, CBR1 TP53 4142/4885PDE4A 4619/4885PDE4B 4620/4885
US-20030130370-A1 Photoinitiators for acrylic esters; reacting an acyl halide with a metal benzoyl phosphine; cable coatings, screen printing stencils, resist materials, colour filters, electrical encapsulation SMARCC1, ARPC5L, DHCR24 TP53 4400/4885PDE4A 4276/4885PDE4B 4273/4885
US-20020026049-A1 Photoinitiators for acrylate coatings DHCR24, NR5A1, NR2C2 TP53 3402/4885PDE4A 4298/4885PDE4B 4454/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.