SCHEMBL5996261

SCHEMBL5996261

CCCCP(=O)(C(=O)c1c(C)cc(C)cc1C)C(=O)c1c(OC)cc(C)cc1OC

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ITGB1 P05556 1/20 0.36
ITGA4 P13612 1/20 0.36
PKM P14618 1/20 0.35
GAA P10253 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
ALDH1A1 P00352 2/20 0.34
LMNA P02545 1/20 0.34
HPGD P15428 1/20 0.34
ALOX5 P09917 1/20 0.34
KDM4E B2RXH2 1/20 0.34
CRHR1 P34998 4/20 0.34
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34
S1PR2 O95136 1/20 0.33
S1PR1 P21453 1/20 0.33
S1PR3 Q99500 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
SCHEMBL5993728 0.94 ELANE (0.38) ITGB1ITGA4SMN1; SMN2KMT2ALMNA
SCHEMBL5993913 0.91 CNR2 (0.34) ITGB1ITGA4GAATDP1L3MBTL1
SCHEMBL444511 0.91 PPARA (0.42) ITGB1ITGA4SMN1; SMN2MEN1KMT2A
SCHEMBL5995310 0.91 TAS1R3 (0.41) GAATDP1L3MBTL1MEN1KMT2A
SCHEMBL28068436 0.90 PPARA (0.41) ITGB1ITGA4SMN1; SMN2MEN1KMT2A
SCHEMBL2497195 0.89 HPGD (0.41) ITGB1ITGA4L3MBTL1SMN1; SMN2MEN1
SCHEMBL5996725 0.88 PPARA (0.44) SMN1; SMN2MEN1KMT2AALDH1A1ALOX5
SCHEMBL5994796 0.86 PKM (0.38) PKMGAASMN1; SMN2MEN1KMT2A
SCHEMBL2064034 0.84 ITGB1 (0.41) ITGB1ITGA4SMN1; SMN2MEN1KMT2A
SCHEMBL5995831 0.83 HDAC3 (0.49) ITGB1ITGA4PKMGAASMN1; SMN2

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 ITGB1 1746/4885ITGA4 1993/4885PKM 4644/4885
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 ITGB1 1859/4885ITGA4 897/4885PKM 4235/4885
US-20020026049-A1 Photoinitiators for acrylate coatings DHCR24, NR5A1, NR2C2 ITGB1 340/4885ITGA4 407/4885PKM 4829/4885

“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.