SCHEMBL714541

SCHEMBL714541

[c]1c(C2CCCCC2)ccc2c1Cc1cc(C3CCCCC3)ccc1-2

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.41
PDK2 Q15119 1/20 0.37
ACMSD Q8TDX5 2/20 0.34
BACE1 P56817 1/20 0.33
KMO O15229 1/20 0.32
CNR2 P34972 2/20 0.31
HSP90AA1 P07900 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
HTR6 P50406 1/20 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
SCHEMBL2968883 0.82 LMNA (0.34) PDK2GAAMAPT
SCHEMBL7938786 0.81 EPHX2 (0.53) EPHX2PDK2ACMSDBACE1KMO
SCHEMBL712934 0.72 EPHX2 (0.39) EPHX2PDK2ACMSDBACE1KMO
SCHEMBL15757392 0.67 EPHX2 (0.40) EPHX2PDK2ACMSDBACE1HSP90AA1
SCHEMBL27862643 0.67 EPHX2 (0.40) EPHX2PDK2ACMSDBACE1KMO
SCHEMBL10879536 0.67 EPHX2 (0.49) EPHX2PDK2ACMSDBACE1KMO
SCHEMBL9746450 0.67 EPHX2 (0.49) EPHX2PDK2ACMSDBACE1KMO
Hydrochloric Acid SCHEMBL27998359 0.66 EPHX2 (0.40) EPHX2PDK2ACMSDBACE1KMO
SCHEMBL1778645 0.65 KMO (0.40) EPHX2PDK2ACMSDBACE1KMO
SCHEMBL16393610 0.64 ALDH1A1 (0.53) PDK2MAPT

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
US-8357765-B2 Process for producing catalyst component for addition polymerization SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-01-22 US disclosed
US-8288490-B2 Process for producing catalyst component for addition polymerization SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-10-16 US disclosed
US-20120053306-A1 PROCESS FOR PRODUCING CATALYST COMPONENT FOR ADDITION POLYMERIZATION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-03-01 US disclosed
US-20120053311-A1 PROCESS FOR PRODUCING CATALYST COMPONENT FOR ADDITION POLYMERIZATION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-03-01 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-20120053306-A1 PROCESS FOR PRODUCING CATALYST COMPONENT FOR ADDITION POLYMERIZATION PPOX, SOD1, AP1M1 EPHX2 1494/4885PDK2 553/4885ACMSD 93/4885

“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.