SCHEMBL5997440

SCHEMBL5997440

CCPC(=O)c1ccc(OC)cc1OC

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.57
HDAC3 O15379 1/20 0.56
HDAC1 Q13547 1/20 0.56
HDAC2 Q92769 1/20 0.56
SMN1; SMN2 Q16637 2/20 0.52
HTT P42858 2/20 0.52
LMNA P02545 2/20 0.52
TP53 P04637 1/20 0.52
MAPT P10636 3/20 0.51
ALDH1A1 P00352 2/20 0.51
HPGD P15428 2/20 0.51
RAD52 P43351 1/20 0.51
KMT2A Q03164 3/20 0.51
ABCG2 Q9UNQ0 2/20 0.51
RAB9A P51151 2/20 0.51
MEN1 O00255 2/20 0.51
TDP1 Q9NUW8 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
TNFRSF1A P19438 1/20 0.50
PKM P14618 2/20 0.49

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
SCHEMBL27489419 0.98 NPC1 (0.55) NPC1HDAC3HDAC1HDAC2SMN1; SMN2
SCHEMBL5997184 0.84 HDAC3 (0.61) NPC1HDAC3HDAC1HDAC2SMN1; SMN2
SCHEMBL5996772 0.83 TP53 (0.59) NPC1HDAC3HDAC1HDAC2SMN1; SMN2
SCHEMBL27489125 0.81 TP53 (0.58) NPC1HDAC3HDAC1HDAC2SMN1; SMN2
SCHEMBL5914630 0.79 SMN1; SMN2 (0.63) NPC1HDAC3HDAC1HDAC2SMN1; SMN2
SCHEMBL5995883 0.79 CYP3A4 (0.50) SMN1; SMN2LMNAKMT2AABCG2CYP1A2
SCHEMBL4653380 0.79 SMN1; SMN2 (0.63) NPC1HDAC3HDAC1HDAC2SMN1; SMN2
SCHEMBL30376093 0.79 SMN1; SMN2 (0.63) NPC1HDAC3HDAC1HDAC2SMN1; SMN2
SCHEMBL5995702 0.78 TP53 (0.55) NPC1HDAC3HDAC1HDAC2SMN1; SMN2
SCHEMBL285924 0.78 NPC1 (0.79) NPC1SMN1; SMN2HTTLMNATP53

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7109250-B2 Multimer forms of acylphosphines and their derivatives CIBA SPECIALTY CHEMICALS CORP. (US) 2006-09-19 US disclosed
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
CN-1589276-A Multimer of acylphosphines and their derivatives CIBA SC HOLDING AG (CH) 2005-03-02 CN disclosed
US-20050004247-A1 Multimer forms of acylphosphines and their derivatives CIBA SPECIALTY CHEMICALS CORP. 2005-01-06 US disclosed
EP-1446410-A1 MULTIMER FORMS OF ACYLPHOSPHINES AND THEIR DERIVATIVES Ciba SC Holding AG (CH) 2004-08-18 EP 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
WO-2003044030-A1 MULTIMER FORMS OF ACYLPHOSPHINES AND THEIR DERIVATIVES CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2003-05-30 WO 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 NPC1 850/4885HDAC3 335/4885HDAC1 1012/4885
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 NPC1 1321/4885HDAC3 1552/4885HDAC1 1863/4885
US-20020026049-A1 Photoinitiators for acrylate coatings DHCR24, NR5A1, NR2C2 NPC1 623/4885HDAC3 247/4885HDAC1 645/4885

“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.