SCHEMBL5994155

SCHEMBL5994155

CCCCP(=O)(C(=O)c1c(C)cccc1C)C(=O)c1c(Cl)cccc1Cl

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 1/20 0.42
ITGB1 P05556 6/20 0.39
ITGA4 P13612 6/20 0.39
ITGA2 P17301 1/20 0.39
ITGB7 P26010 1/20 0.39
HPGD P15428 1/20 0.38
DRD3 P35462 1/20 0.38
UTS2R Q9UKP6 1/20 0.37
PLK1 P53350 1/20 0.37
ALDH1A1 P00352 1/20 0.36
TRPM4 Q8TD43 1/20 0.36
MAPK14 Q16539 1/20 0.36
TSHR P16473 1/20 0.35
F2R P25116 1/20 0.35
ALDH2 P05091 1/20 0.35
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35

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
SCHEMBL6467225 0.91 TSHR (0.41) ALDH1A1TSHRF2R
SCHEMBL5995028 0.91 MEN1 (0.40) TYK2ITGB1ITGA4HPGDDRD3
SCHEMBL5996367 0.91 ALDH1A1 (0.36) TYK2ITGB1ITGA4HPGDUTS2R
SCHEMBL5994505 0.87 RAB9A (0.38) HPGDDRD3PLK1ALDH1A1F2R
SCHEMBL2769886 0.87 PLK1 (0.44) ITGB1ITGA4HPGDDRD3PLK1
SCHEMBL58428 0.87 PLK1 (0.44) ITGB1ITGA4HPGDDRD3PLK1
SCHEMBL7622733 0.87 PLK1 (0.44) ITGB1ITGA4HPGDDRD3PLK1
SCHEMBL6470382 0.86 CETP (0.42) ALDH1A1TSHRF2R
SCHEMBL6465547 0.85 CETP (0.44) ALDH1A1F2R
SCHEMBL5996451 0.85 TYK2 (0.46) TYK2ITGB1ITGA4ITGA2ITGB7

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 2818/4885ITGB1 1746/4885ITGA4 1993/4885
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 3482/4885ITGB1 1859/4885ITGA4 897/4885
US-20020026049-A1 Photoinitiators for acrylate coatings DHCR24, NR5A1, NR2C2 TYK2 2581/4885ITGB1 340/4885ITGA4 407/4885

“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.