SCHEMBL6284568

SCHEMBL6284568

C=C(C)COC(=O)c1cccc(-c2ccccc2)c1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.52
TDP1 Q9NUW8 1/20 0.52
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
LMNA P02545 1/20 0.49
KDM4E B2RXH2 1/20 0.49
KMO O15229 1/20 0.49
NPSR1 Q6W5P4 1/20 0.47

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
SCHEMBL2588385 0.87 MAPK1 (0.49) MAPTNPC1RAB9AKDM4E
SCHEMBL6283630 0.86 KDM4E (0.66) MAPTNPC1RAB9ALMNAKDM4E
SCHEMBL6354305 0.85 RAB9A (0.57) TDP1NPC1RAB9ALMNAKDM4E
SCHEMBL6282138 0.81 TDP1 (0.49) MAPTTDP1NPC1RAB9ALMNA
SCHEMBL2404818 0.81 NPC1 (0.59) MAPTNPC1RAB9A
SCHEMBL2835091 0.80 NPC1 (0.54) TDP1NPC1RAB9ALMNA
SCHEMBL21312162 0.79 TDP1 (0.50) MAPTTDP1NPC1RAB9ALMNA
SCHEMBL27668643 0.79 NPC1 (0.56) MAPTTDP1NPC1RAB9AKDM4E
SCHEMBL15194995 0.78 LMNA (0.72) TDP1NPC1RAB9ALMNAKMO
SCHEMBL21312160 0.78 TDP1 (0.46) MAPTTDP1NPC1RAB9ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6846900-B2 POLYVALENT CARBOXYLIC ACID ESTER, PROCESS FOR PRODUCING THE CARBOXYLIC ACID ESTER, PLASTIC LENS COMPOSITION USING THE CARBOXYLIC ESTER, PLASTIC LENS OBTAINED BY CURING THE COMPOSITION AND PROCESS FOR PRODUCING THE PLASTIC LENS SHOWA DENKO K.K. (JP) 2005-01-25 US disclosed
US-20030144447-A1 Novel polyvalent carboxylic acid ester and their use in plastic lens compositions SHOW A DENKO K.K. (JP) 2003-07-31 US disclosed
WO-2002079140-A1 NOVEL POLYVALENT CARBOXYLIC ACID ESTERS AND THEIR USE IN PLASTIC LENS COMPOSITIONS SHOWA DENKO K. K. (JP) 2002-10-10 WO 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 (1 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-20030144447-A1 Novel polyvalent carboxylic acid ester and their use in plastic lens compositions VCL, VIM, CRYAA MAPT 143/4885TDP1 3601/4885NPC1 4781/4885

“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.