SCHEMBL5997928

SCHEMBL5997928

CCc1cccc(CC)c1C(=O)P(=O)(C(=O)c1c(OC)cc(OC)cc1OC)C(C)CC

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.37
MAPT P10636 1/20 0.37
ABCG2 Q9UNQ0 3/20 0.37
GAA P10253 2/20 0.37
HPGD P15428 2/20 0.37
PKM P14618 1/20 0.37
HTT P42858 1/20 0.37
CYP3A4 P08684 2/20 0.37
USP2 O75604 1/20 0.37
MAPK1 P28482 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
TP53 P04637 1/20 0.36
TSHR P16473 1/20 0.36
CALM1 P0DP23 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36

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
SCHEMBL5996128 0.91 MAPT (0.45) MAPTABCG2CYP3A4USP2MAPK1
SCHEMBL5996474 0.90 ALDH1A1 (0.43) ALDH1A1MAPTHPGDHTTSMN1; SMN2
SCHEMBL5995447 0.88 TAS1R3 (0.40) ALDH1A1MAPTABCG2CYP3A4USP2
SCHEMBL5997621 0.87 SMN1; SMN2 (0.43) ALDH1A1MAPTABCG2HPGDHTT
SCHEMBL5994376 0.87 ABCG2 (0.41) ALDH1A1MAPTABCG2CYP3A4USP2
SCHEMBL6467280 0.84 GABRA1 (0.39) ALDH1A1GAAHTTMEN1KMT2A
SCHEMBL5997073 0.84 AKR1C4 (0.38) ALDH1A1MAPTGAAHTTMAPK1
SCHEMBL5996902 0.83 KMT2A (0.43) ALDH1A1MAPTABCG2GAAHPGD
SCHEMBL5997460 0.83 TP53 (0.50) ALDH1A1ABCG2GAAHPGDPKM
SCHEMBL5994441 0.83 GAA (0.39) ALDH1A1MAPTABCG2GAAHPGD

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 ALDH1A1 974/4885MAPT 4713/4885ABCG2 3623/4885
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 ALDH1A1 1088/4885MAPT 4813/4885ABCG2 3245/4885
US-20020026049-A1 Photoinitiators for acrylate coatings DHCR24, NR5A1, NR2C2 ALDH1A1 835/4885MAPT 4467/4885ABCG2 3003/4885

“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.