SCHEMBL5996459

SCHEMBL5996459

Cc1cccc(C)c1C(=O)[PH](=O)CCC(=O)c1c(Cl)cccc1Cl

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FEN1 P39748 1/20 0.41
TYK2 P29597 1/20 0.40
ITGB1 P05556 7/20 0.37
ITGA4 P13612 7/20 0.37
ALDH1A1 P00352 1/20 0.37
ITGA2 P17301 1/20 0.37
ITGB7 P26010 1/20 0.37
UTS2R Q9UKP6 1/20 0.35
PTGS2 P35354 2/20 0.35
KMT2A Q03164 1/20 0.35
FABP3 P05413 1/20 0.35
FABP4 P15090 1/20 0.35
TRPM4 Q8TD43 1/20 0.34
ALDH2 P05091 1/20 0.33
ELANE P08246 1/20 0.33
HCRTR1 O43613 1/20 0.33
HCRTR2 O43614 1/20 0.33
RORC P51449 1/20 0.32

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
SCHEMBL5996320 0.90 FFAR1 (0.34) FEN1TYK2ITGB1ITGA4ALDH1A1
SCHEMBL5996318 0.90 KMT2A (0.43) FEN1TYK2ALDH1A1PTGS2KMT2A
SCHEMBL5995199 0.87 RAB9A (0.36) FEN1TYK2ALDH1A1PTGS2KMT2A
SCHEMBL5995888 0.82 GABRA1 (0.34) ITGB1ITGA4ALDH1A1PTGS2KMT2A
SCHEMBL5997924 0.82 MAPT (0.36) ALDH1A1KMT2A
SCHEMBL5997542 0.82 MAPT (0.36) ALDH1A1KMT2A
SCHEMBL5996161 0.82 CA12 (0.41) FEN1ITGB1ITGA4ALDH1A1FABP4
SCHEMBL5995848 0.79 ACHE (0.35) ALDH1A1
SCHEMBL5997838 0.79 ACHE (0.35) ALDH1A1
SCHEMBL5995908 0.79 ALDH1A1 (0.34) ITGB1ITGA4ALDH1A1ITGB7KMT2A

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 FEN1 3857/4885TYK2 2818/4885ITGB1 1746/4885
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 FEN1 4789/4885TYK2 3482/4885ITGB1 1859/4885
US-20020026049-A1 Photoinitiators for acrylate coatings DHCR24, NR5A1, NR2C2 FEN1 4113/4885TYK2 2581/4885ITGB1 340/4885

“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.