SCHEMBL5997940

SCHEMBL5997940

CCPC(=O)c1c(C)cccc1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 1/20 0.44
ALDH1A1 P00352 3/20 0.42
FABP3 P05413 1/20 0.41
FABP4 P15090 1/20 0.41
TRPM4 Q8TD43 1/20 0.40
UTS2R Q9UKP6 1/20 0.39
FEN1 P39748 1/20 0.39
ITGB1 P05556 4/20 0.38
ITGA4 P13612 4/20 0.38
ITGA2 P17301 1/20 0.38
ITGB7 P26010 1/20 0.38
ALDH2 P05091 1/20 0.36
ELANE P08246 1/20 0.36
HCRTR1 O43613 1/20 0.36
HCRTR2 O43614 1/20 0.36
HPGD P15428 1/20 0.36
KMT2A Q03164 1/20 0.35
PTGS2 P35354 1/20 0.35
AKR1B1 P15121 1/20 0.35
ITGB2 P05107 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
SCHEMBL27507074 0.98 TYK2 (0.43) TYK2ALDH1A1FABP3FABP4TRPM4
SCHEMBL5996807 0.91 ALDH1A1 (0.50) TYK2ALDH1A1FEN1HPGDKMT2A
SCHEMBL5994208 0.87 CA12 (0.38) ALDH1A1HPGDKMT2A
SCHEMBL5996916 0.84 TYK2 (0.40) TYK2ALDH1A1FABP3FABP4TRPM4
SCHEMBL5996981 0.82 TYK2 (0.41) TYK2ALDH1A1FABP3FABP4TRPM4
SCHEMBL27487732 0.81 TYK2 (0.40) TYK2ALDH1A1FABP3FABP4TRPM4
SCHEMBL5994811 0.80 CA12 (0.49) ALDH1A1FABP4ITGB1ITGA4
SCHEMBL5997553 0.79 ALDH1A1 (0.41) ALDH1A1KMT2APTGS2
SCHEMBL5994172 0.79 GAA (0.38) TYK2ALDH1A1FABP3FABP4TRPM4
SCHEMBL5995454 0.78 DPP4 (0.36) ALDH1A1KMT2A

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7109250-B2 Multimer forms of acylphosphines and their derivatives CIBA SPECIALTY CHEMICALS CORP. (US) 2006-09-19 US disclosed
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
CN-1589276-A Multimer of acylphosphines and their derivatives CIBA SC HOLDING AG (CH) 2005-03-02 CN disclosed
US-20050004247-A1 Multimer forms of acylphosphines and their derivatives CIBA SPECIALTY CHEMICALS CORP. 2005-01-06 US disclosed
EP-1446410-A1 MULTIMER FORMS OF ACYLPHOSPHINES AND THEIR DERIVATIVES Ciba SC Holding AG (CH) 2004-08-18 EP 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
WO-2003044030-A1 MULTIMER FORMS OF ACYLPHOSPHINES AND THEIR DERIVATIVES CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2003-05-30 WO 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 974/4885FABP3 3788/4885
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 1088/4885FABP3 4397/4885
US-20020026049-A1 Photoinitiators for acrylate coatings DHCR24, NR5A1, NR2C2 TYK2 2581/4885ALDH1A1 835/4885FABP3 4336/4885

“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.