SCHEMBL5996541

SCHEMBL5996541

CCCCCCP(=O)(CC(C)CC(C)(C)C)C(=O)c1c(OC)cccc1OC

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 1/20 0.43
PLK1 P53350 1/20 0.38
CETP P11597 3/20 0.35
TSHR P16473 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA7 P43166 1/20 0.34
CA9 Q16790 1/20 0.34
CA14 Q9ULX7 1/20 0.34
ALOX5 P09917 1/20 0.34
PTGS2 P35354 1/20 0.34
CNR2 P34972 2/20 0.33
SMPD1 P17405 1/20 0.33
CNR1 P21554 1/20 0.33

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
SCHEMBL5997328 1.00 PPARA (0.43) PPARAPLK1CETPTSHRSMN1; SMN2
SCHEMBL5996221 1.00 PPARA (0.43) PPARAPLK1CETPTSHRSMN1; SMN2
SCHEMBL5997431 1.00 PPARA (0.43) PPARAPLK1CETPTSHRSMN1; SMN2
SCHEMBL5993349 0.99 PPARA (0.41) PPARAPLK1CETPTSHRSMN1; SMN2
SCHEMBL5996127 0.96 PPARA (0.39) PPARAPLK1TSHRSMN1; SMN2CA12
SCHEMBL5994677 0.91 CA12 (0.37) PPARATSHRSMN1; SMN2CA12CA1
SCHEMBL5997076 0.87 CA12 (0.41) TSHRSMN1; SMN2CA12CA1CA2
SCHEMBL5995681 0.86 CA12 (0.39) PPARATSHRSMN1; SMN2CA12CA1
SCHEMBL5994500 0.86 PPARA (0.48) PPARAPLK1CETPSMN1; SMN2CA12
SCHEMBL5994493 0.86 PPARA (0.48) PPARAPLK1CETPSMN1; SMN2CA12

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 4 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-6737549-B2 PHOTOINITIATORS FOR ACRYLATE COATINGS CIBA SPECIALTY CHEMICALS CORPORATION 2004-05-18 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 (2 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-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 PPARA 2606/4885PLK1 4785/4885CETP 3462/4885
US-20020026049-A1 Photoinitiators for acrylate coatings DHCR24, NR5A1, NR2C2 PPARA 2465/4885PLK1 4389/4885CETP 2363/4885

“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.