SCHEMBL5994053

SCHEMBL5994053

CCc1cccc(CC)c1C(=O)CC[PH](=O)C(=O)c1c(C)cc(C(C)(C)C)cc1C

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.33
RXRA P19793 3/20 0.33
RXRB P28702 3/20 0.33
GABRA1 P14867 1/20 0.33
GABRB2 P47870 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
RXRG P48443 1/20 0.32
POLB P06746 1/20 0.31
NR1H4 Q96RI1 1/20 0.30
HPGD P15428 1/20 0.30
TSHR P16473 1/20 0.30
RAB9A P51151 1/20 0.30
SHBG P04278 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
KCNJ6 P48051 1/20 0.30
KCNJ5 P48544 1/20 0.30
KCNJ3 P48549 1/20 0.30
HTR1D P28221 1/20 0.30
HTR1B P28222 1/20 0.30

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
SCHEMBL5996163 0.88 KMT2A (0.34) GABRA1GABRB2HPGDSHBG
SCHEMBL5997838 0.88 ACHE (0.35) ACHERXRARXRBTDP1RXRG
SCHEMBL5995848 0.88 ACHE (0.35) ACHERXRARXRBTDP1RXRG
SCHEMBL5995888 0.87 GABRA1 (0.34) GABRA1GABRB2TDP1POLBSHBG
SCHEMBL5993536 0.87 HTR1D (0.36) ACHERXRARXRBTDP1RXRG
SCHEMBL5995199 0.85 RAB9A (0.36) ACHERXRARXRBTDP1RXRG
SCHEMBL5996293 0.83 RXFP1 (0.37) POLBHPGD
SCHEMBL5995234 0.83 ACHE (0.35) ACHERXRARXRBTDP1RXRG
SCHEMBL5996440 0.83 KDM4E (0.35) RXRARXRBRXRGPOLBHPGD
SCHEMBL5995828 0.83 KDM4E (0.35) RXRARXRBRXRGPOLBHPGD

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 ACHE 4708/4885RXRA 440/4885RXRB 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 ACHE 4598/4885RXRA 2093/4885RXRB 2536/4885
US-20020026049-A1 Photoinitiators for acrylate coatings DHCR24, NR5A1, NR2C2 ACHE 4557/4885RXRA 1279/4885RXRB 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.