SCHEMBL6280145

SCHEMBL6280145

C=C(C)C(=O)OCCc1ccc2ccccc2c1C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.40
APEX1 P27695 1/20 0.40
HTT P42858 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
MMP3 P08254 3/20 0.40
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
CYP1A2 P05177 1/20 0.40
GLA P06280 1/20 0.40
HPGD P15428 1/20 0.40
CYP2C19 P33261 1/20 0.40
KMT2A Q03164 1/20 0.40
HSD17B10 Q99714 1/20 0.40
THRB P10828 1/20 0.38
CHRM5 P08912 1/20 0.36
CHRM1 P11229 1/20 0.36
METAP2 P50579 1/20 0.36
METAP1 P53582 1/20 0.36
NCEH1 Q6PIU2 1/20 0.36

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
SCHEMBL31467476 0.82 CDYL (0.49) TDP1KDM4EMEN1ALDH1A1KMT2A
SCHEMBL68440 0.82 CDYL (0.49) TDP1KDM4EMEN1ALDH1A1KMT2A
SCHEMBL5145324 0.81 NCEH1 (0.39) POLBAPEX1HTTTDP1KDM4E
SCHEMBL28190753 0.81 WDR5 (0.43) POLBAPEX1HTTTDP1KDM4E
SCHEMBL6283658 0.81 THRB (0.50) MMP3KDM4EMEN1ALDH1A1CYP1A2
Hydrochloric Acid SCHEMBL31467475 0.80 CDYL (0.47) TDP1KDM4EMEN1ALDH1A1KMT2A
SCHEMBL28189969 0.80 WDR5 (0.42) POLBAPEX1HTTTDP1KDM4E
SCHEMBL6280134 0.80 WDR5 (0.44) POLBAPEX1HTTTDP1KDM4E
SCHEMBL36344 0.77 POLB (0.43) POLBAPEX1HTTTDP1THRB
SCHEMBL8144939 0.76 POLB (0.42) POLBAPEX1HTTTDP1KDM4E

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 5 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-20040236064-A1 Plastic lens material, plastic lens composition, plastic lens obtained by curing the composition and process for producing the plastic lens SHOWA DENKO K.K. (JP) 2004-11-25 US disclosed
US-20030208019-A1 Plastic lens composition, plastic lens, and process for producing the plastic lens SHOWA DENKO K.K. (JP) 2003-11-06 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 POLB 2620/4885APEX1 3307/4885HTT 406/4885

“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.