SCHEMBL5994876

SCHEMBL5994876

CCCCC(CC)CP(=O)(C(=O)c1c(C)cc(C)cc1C)C1CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 4/20 0.40
TAS1R1 Q7RTX1 4/20 0.40
TAS1R2 Q8TE23 4/20 0.40
TSHR P16473 4/20 0.34
POLB P06746 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
BCL2L1 Q07817 1/20 0.34
NR1I2 O75469 1/20 0.33
MAPK1 P28482 2/20 0.33
ALDH1A1 P00352 2/20 0.33
EPHX2 P34913 1/20 0.32
GAA P10253 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
CNR2 P34972 1/20 0.31
LMNA P02545 1/20 0.31
HTT P42858 1/20 0.31
CYP3A4 P08684 2/20 0.31
CA2 P00918 1/20 0.31
KMT2A Q03164 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL5998081 0.99 TAS1R3 (0.39) TAS1R3TAS1R1TAS1R2TSHRPOLB
SCHEMBL5994301 0.82 TAS1R3 (0.47) TAS1R3TAS1R1TAS1R2TSHRPOLB
SCHEMBL5995810 0.81 TAS1R3 (0.46) TAS1R3TAS1R1TAS1R2TSHRPOLB
SCHEMBL5997053 0.80 TAS1R3 (0.44) TAS1R3TAS1R1TAS1R2TSHRPOLB
SCHEMBL5996831 0.80 TAS1R3 (0.48) TAS1R3TAS1R1TAS1R2ALDH1A1EPHX2
SCHEMBL6469414 0.80 BCL2L1 (0.39) TSHRPOLBSMN1; SMN2BCL2L1MAPK1
SCHEMBL5994835 0.80 TAS1R3 (0.45) TAS1R3TAS1R1TAS1R2TSHRPOLB
SCHEMBL5996170 0.80 TAS1R3 (0.45) TAS1R3TAS1R1TAS1R2TSHRPOLB
SCHEMBL5996103 0.80 TAS1R3 (0.45) TAS1R3TAS1R1TAS1R2TSHRPOLB
SCHEMBL5993426 0.80 TAS1R3 (0.45) TAS1R3TAS1R1TAS1R2TSHRPOLB

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 TAS1R3 2305/4885TAS1R1 2690/4885TAS1R2 3235/4885
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 TAS1R3 3748/4885TAS1R1 3587/4885TAS1R2 3474/4885
US-20020026049-A1 Photoinitiators for acrylate coatings DHCR24, NR5A1, NR2C2 TAS1R3 737/4885TAS1R1 1091/4885TAS1R2 1514/4885

“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.