SCHEMBL5993532

SCHEMBL5993532

CCP(=O)(C(=O)c1c(C)cc(C(C)(C)C)cc1C)C(=O)c1c(C)cc(C(C)(C)C)cc1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.39
TSHR P16473 1/20 0.39
RAB9A P51151 1/20 0.39
HMGCR P04035 2/20 0.36
HTR1D P28221 2/20 0.36
HTR1B P28222 1/20 0.36
RXRB P28702 3/20 0.36
ALDH1A1 P00352 2/20 0.36
RXRA P19793 2/20 0.36
POLB P06746 1/20 0.35
HSP90AA1 P07900 1/20 0.34
HSP90AB1 P08238 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
NR5A2 O00482 1/20 0.33
NR5A1 Q13285 1/20 0.33
ESR1 P03372 1/20 0.33
ESR2 Q92731 1/20 0.33
GABRA1 P14867 1/20 0.33
GABRB2 P47870 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
SCHEMBL5995818 0.95 HPGD (0.39) HPGDTSHRRAB9AHMGCRHTR1D
SCHEMBL5995846 0.92 SMN1; SMN2 (0.37) HPGDTSHRRAB9ARXRBALDH1A1
SCHEMBL5995866 0.88 ACLY (0.35) HPGDTSHRRAB9AHMGCRRXRB
SCHEMBL5994046 0.88 GABRA1 (0.36) HPGDTSHRRAB9ARXRBALDH1A1
SCHEMBL5995192 0.87 RAB9A (0.40) RAB9AALDH1A1POLBMEN1KMT2A
SCHEMBL5996227 0.86 CYP3A4 (0.39) HPGDTSHRKMT2A
SCHEMBL5996043 0.86 CNR2 (0.37) HPGDTSHRRAB9AHMGCRALDH1A1
SCHEMBL6818101 0.85 ACHE (0.38) HPGDALDH1A1POLB
SCHEMBL5995482 0.85 TAS1R3 (0.42) TSHRALDH1A1MEN1KMT2A
SCHEMBL5996289 0.84 RXFP1 (0.42)

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 HPGD 2368/4885TSHR 1096/4885RAB9A 3300/4885
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 HPGD 3137/4885TSHR 4029/4885RAB9A 1141/4885
US-20020026049-A1 Photoinitiators for acrylate coatings DHCR24, NR5A1, NR2C2 HPGD 3884/4885TSHR 1670/4885RAB9A 2807/4885

“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.