SCHEMBL5994046

SCHEMBL5994046

CCc1cccc(CC)c1C(=O)P(=O)(CC)C(=O)c1c(C)cc(C(C)(C)C)cc1C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.36
GABRB2 P47870 1/20 0.36
RXRB P28702 3/20 0.35
RXRA P19793 2/20 0.35
KCNJ6 P48051 1/20 0.34
KCNJ5 P48544 1/20 0.34
KCNJ3 P48549 1/20 0.34
ACHE P22303 2/20 0.34
SMN1; SMN2 Q16637 3/20 0.33
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
EPHX2 P34913 1/20 0.33
POLB P06746 1/20 0.33
HPGD P15428 3/20 0.33
TP53 P04637 1/20 0.33
THRB P10828 1/20 0.33
HTT P42858 1/20 0.33
PTPN5 P54829 1/20 0.33
TSHR P16473 1/20 0.33
RAB9A P51151 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
SCHEMBL5995846 0.90 SMN1; SMN2 (0.37) RXRBRXRAACHESMN1; SMN2MEN1
SCHEMBL5993532 0.88 HPGD (0.39) GABRA1GABRB2RXRBRXRAMEN1
SCHEMBL5996144 0.87 KMT2A (0.40) GABRA1GABRB2SMN1; SMN2MEN1KMT2A
SCHEMBL5995560 0.87 TSHR (0.35) GABRA1GABRB2RXRBRXRASMN1; SMN2
SCHEMBL5997721 0.87 KMT2A (0.33) GABRA1GABRB2RXRBRXRAACHE
SCHEMBL5995884 0.85 GABRA1 (0.38) GABRA1GABRB2SMN1; SMN2MEN1KMT2A
SCHEMBL5995192 0.85 RAB9A (0.40) KCNJ6KCNJ5KCNJ3ACHEMEN1
SCHEMBL5995818 0.84 HPGD (0.39) RXRBRXRASMN1; SMN2MEN1KMT2A
SCHEMBL5997120 0.83 KCNK3 (0.32) RXRBRXRASMN1; SMN2MEN1KMT2A
SCHEMBL7187663 0.83 POLB (0.36) GABRA1GABRB2RXRBRXRAKCNJ6

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 GABRA1 2372/4885GABRB2 2252/4885RXRB 550/4885
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 GABRA1 3077/4885GABRB2 2736/4885RXRB 2536/4885
US-20020026049-A1 Photoinitiators for acrylate coatings DHCR24, NR5A1, NR2C2 GABRA1 3354/4885GABRB2 3498/4885RXRB 1585/4885

“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.