SCHEMBL6283630

SCHEMBL6283630

C=C(C)COC(=O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.66
ALDH1A1 P00352 4/20 0.54
NPY1R P25929 1/20 0.54
NPY2R P49146 1/20 0.54
SMN1; SMN2 Q16637 6/20 0.53
SLC1A5 Q15758 1/20 0.53
MAPT P10636 6/20 0.52
PDCD1 Q15116 1/20 0.51
CD274 Q9NZQ7 1/20 0.51
NPC1 O15118 4/20 0.51
RAB9A P51151 4/20 0.51
LMNA P02545 2/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
GAA P10253 1/20 0.49
HPGD P15428 2/20 0.47
USP2 O75604 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
SCHEMBL6354305 0.90 RAB9A (0.57) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL1002049 0.88 MAPK1 (0.50) KDM4EALDH1A1SMN1; SMN2MAPTNPC1
SCHEMBL6284568 0.86 MAPT (0.52) KDM4EMAPTNPC1RAB9ALMNA
SCHEMBL27709389 0.84 MAPT (0.51) KDM4EALDH1A1SMN1; SMN2MAPTNPC1
SCHEMBL17231742 0.81 MAPK1 (0.62) KDM4EALDH1A1SMN1; SMN2MAPTNPC1
SCHEMBL10870309 0.81 MAPK1 (0.45) KDM4EALDH1A1SMN1; SMN2MAPTNPC1
SCHEMBL116940 0.80 KDM4E (0.53) KDM4EALDH1A1NPY1RNPY2RSMN1; SMN2
SCHEMBL2832607 0.79 LMNA (0.51) KDM4EALDH1A1SMN1; SMN2MAPTNPC1
SCHEMBL24106782 0.79 MEN1 (0.70) KDM4EALDH1A1SMN1; SMN2SLC1A5MAPT
SCHEMBL570961 0.79 MEN1 (0.70) KDM4EALDH1A1SMN1; SMN2SLC1A5MAPT

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 KDM4E 204/4885ALDH1A1 1516/4885NPY1R 3592/4885

“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.