SCHEMBL5996465

SCHEMBL5996465

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

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 1/20 0.40
ALDH1A1 P00352 1/20 0.38
ITGB1 P05556 8/20 0.38
ITGA4 P13612 8/20 0.38
ITGA2 P17301 1/20 0.38
ITGB7 P26010 1/20 0.38
UTS2R Q9UKP6 1/20 0.36
FABP3 P05413 1/20 0.35
FABP4 P15090 1/20 0.35
RORC P51449 3/20 0.34
CYP2C9 P11712 1/20 0.34
ALDH2 P05091 1/20 0.34
CXCL8 P10145 1/20 0.33
HCRTR1 O43613 1/20 0.33
HCRTR2 O43614 1/20 0.33
ITGB2 P05107 1/20 0.33
ICAM1 P05362 1/20 0.33
ITGAL P20701 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
SCHEMBL6402780 0.90 MEN1 (0.39) TYK2ALDH1A1ITGB1ITGA4ITGA2
SCHEMBL5996325 0.90 MRGPRX4 (0.34) TYK2ITGB1ITGA4ITGA2ITGB7
SCHEMBL5995203 0.86 RAB9A (0.36) TYK2ALDH1A1
SCHEMBL5997547 0.82 HPGD (0.37) ALDH1A1
SCHEMBL6402169 0.82 HPGD (0.37) ALDH1A1
SCHEMBL5996168 0.81 CA12 (0.42) ALDH1A1ITGB1ITGA4FABP4
SCHEMBL5995892 0.81 ITGB1 (0.36) ALDH1A1ITGB1ITGA4
SCHEMBL5997841 0.78 ACHE (0.36) ALDH1A1
SCHEMBL5995913 0.78 ITGB1 (0.33) ALDH1A1ITGB1ITGA4ITGB7RORC
SCHEMBL5995853 0.78 ACHE (0.36) ALDH1A1

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 TYK2 2818/4885ALDH1A1 974/4885ITGB1 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 TYK2 3482/4885ALDH1A1 1088/4885ITGB1 1859/4885
US-20020026049-A1 Photoinitiators for acrylate coatings DHCR24, NR5A1, NR2C2 TYK2 2581/4885ALDH1A1 835/4885ITGB1 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.