SCHEMBL4476507

SCHEMBL4476507

COc1c(O)c(C)c(CCl)c(OC)c1OC

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.32
IMPDH2 P12268 5/20 0.31
IGF1R P08069 1/20 0.31
SRC P12931 1/20 0.31
AXL P30530 1/20 0.31
PTK2 Q05397 1/20 0.31
AURKB Q96GD4 1/20 0.31
ALK Q9UM73 1/20 0.31
IMPDH1 P20839 1/20 0.30
ALOX5 P09917 4/20 0.30

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
SCHEMBL8924397 0.83 IMPDH2 (0.40) IMPDH2IMPDH1
SCHEMBL5086099 0.82 CA1 (0.30)
SCHEMBL13866596 0.76 CA2 (0.31)
SCHEMBL17431561 0.76 IMPDH2 (0.37) TDP1IMPDH2IGF1RSRCAXL
SCHEMBL5145143 0.76
SCHEMBL12143217 0.74 TDP1 (0.46) TDP1IMPDH2
SCHEMBL4559180 0.73 APP (0.51) IMPDH2ALOX5
SCHEMBL14458460 0.73 IMPDH2 (0.33) IMPDH2IMPDH1
SCHEMBL2029504 0.73 IMPDH2 (0.33) IMPDH2IMPDH1
SCHEMBL14089301 0.72 TDP1 (0.40) TDP1IMPDH2IMPDH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102775290-B 2-chloromethyl-5,6-dimethoxy-3-methyl isophthalic acid, the preparation method of 4-para benzoquinone KUNMING UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2015-08-26 CN claimed
US-7528271-B2 Intermediates, process for their preparation and synthesis of 1,4-benzoquiones BERGEN TEKNOLOGIOVERFORING AS (NO) 2009-05-05 US disclosed
WO-2008140328-A2 NOVEL INTERMEDIATES, PROCESS FOR THEIR PREPARATION AND SYNTHESIS OF 1,4-BENZOQUINONES BERGEN TEKNOLOGIOVERFORING AS (NO) 2008-11-20 WO disclosed
US-20080287702-A1 Novel intermediates, process for their preparation and synthesis of 1, 4-benzoquiones BERGEN TEKNOLOGIOVERFORING AS (NO) 2008-11-20 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 (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-20080287702-A1 Novel intermediates, process for their preparation and synthesis of 1, 4-benzoquiones SQOR, NDUFB10, UQCRB TDP1 3338/4885IMPDH2 2086/4885IGF1R 2589/4885

“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.