SCHEMBL5995649

SCHEMBL5995649

CCOc1cccc(OCC)c1C(=O)P(=O)(C(=O)c1c(C)cccc1C)C(C)CC

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.39
KDM4E B2RXH2 2/20 0.39
KMT2A Q03164 1/20 0.39
TAS1R3 Q7RTX0 3/20 0.38
TAS1R1 Q7RTX1 3/20 0.38
GLA P06280 1/20 0.37
HCRTR1 O43613 2/20 0.37
TDP1 Q9NUW8 2/20 0.36
ALDH1A1 P00352 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
TAS1R2 Q8TE23 1/20 0.35
PTGS1 P23219 1/20 0.34
PTGS2 P35354 1/20 0.34
TP53 P04637 1/20 0.34

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
SCHEMBL446841 0.93 L3MBTL1 (0.43) L3MBTL1KDM4EKMT2AGLAHCRTR1
SCHEMBL5997055 0.91 TAS1R3 (0.38) L3MBTL1KDM4EKMT2ATAS1R3TAS1R1
SCHEMBL5996657 0.88 RXFP1 (0.39) L3MBTL1KDM4EKMT2ATAS1R3TAS1R1
SCHEMBL5996241 0.88 SMN1; SMN2 (0.47) L3MBTL1KDM4EKMT2AGLAALDH1A1
SCHEMBL5996509 0.88 TAS1R3 (0.46) KDM4ETAS1R3TAS1R1ALDH1A1HTT
SCHEMBL6466911 0.87 L3MBTL1 (0.38) L3MBTL1KDM4EKMT2ATAS1R3TAS1R1
SCHEMBL5997621 0.83 SMN1; SMN2 (0.43) KDM4EALDH1A1HTTSMN1; SMN2TP53
SCHEMBL5996195 0.82 TAS1R3 (0.41) KDM4EKMT2ATAS1R3TAS1R1ALDH1A1
SCHEMBL5994900 0.82 TAS1R3 (0.39) L3MBTL1KDM4EKMT2ATAS1R3TAS1R1
SCHEMBL5995447 0.81 TAS1R3 (0.40) KMT2ATAS1R3TAS1R1ALDH1A1SMN1; 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 L3MBTL1 1852/4885KDM4E 3308/4885KMT2A 1784/4885
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 L3MBTL1 1879/4885KDM4E 662/4885KMT2A 761/4885
US-20020026049-A1 Photoinitiators for acrylate coatings DHCR24, NR5A1, NR2C2 L3MBTL1 2570/4885KDM4E 2655/4885KMT2A 1577/4885

“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.