SCHEMBL5995285

SCHEMBL5995285

COc1ccc(C(=O)CC[PH](=O)C(=O)c2c(C)cc(C)cc2C)c(OC)c1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.48
NPC1 O15118 4/20 0.48
PKM P14618 1/20 0.48
SMN1; SMN2 Q16637 3/20 0.45
HTT P42858 2/20 0.45
LMNA P02545 1/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
MAPT P10636 1/20 0.44
L3MBTL1 Q9Y468 3/20 0.43
TP53 P04637 1/20 0.43
CAPN1 P07384 1/20 0.41
USP2 O75604 1/20 0.41
CASP3 P42574 1/20 0.41
SENP8 Q96LD8 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
SENP6 Q9GZR1 1/20 0.41
ALDH1A1 P00352 1/20 0.41
RXFP1 Q9HBX9 1/20 0.40

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
SCHEMBL5994251 0.91 RAB9A (0.51) RAB9ANPC1PKMSMN1; SMN2HTT
SCHEMBL5996132 0.90 RAB9A (0.46) RAB9ANPC1PKMSMN1; SMN2HTT
SCHEMBL5993320 0.88 RAB9A (0.52) RAB9ANPC1PKMSMN1; SMN2HTT
SCHEMBL5994809 0.86 RAB9A (0.53) RAB9ANPC1PKMSMN1; SMN2HTT
SCHEMBL5994603 0.85 CYP2D6 (0.44) SMN1; SMN2LMNAUSP2ALDH1A1
SCHEMBL5995324 0.83 CYP2D6 (0.41) SMN1; SMN2LMNAMEN1KMT2AMAPT
SCHEMBL5994817 0.81 FASN (0.36) PKMSMN1; SMN2LMNAMEN1KMT2A
SCHEMBL5997089 0.78 CA12 (0.40) MEN1KMT2AMAPTALDH1A1
SCHEMBL5997931 0.77 CYP2D6 (0.43) RAB9ANPC1SMN1; SMN2LMNAMEN1
SCHEMBL5996721 0.76 CTNNB1 (0.39) LMNA

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 RAB9A 3300/4885NPC1 850/4885PKM 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 RAB9A 1141/4885NPC1 1321/4885PKM 4235/4885
US-20020026049-A1 Photoinitiators for acrylate coatings DHCR24, NR5A1, NR2C2 RAB9A 2807/4885NPC1 623/4885PKM 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.