SCHEMBL6909786

SCHEMBL6909786

CCCCCC(CC)OC(=O)OOOC(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 1/20 0.37
PRKCD Q05655 1/20 0.37
CA2 P00918 4/20 0.33
CA1 P00915 3/20 0.33
CTSK P43235 1/20 0.33
SMPD1 P17405 3/20 0.33
MAPK1 P28482 2/20 0.33
PRSS1 P07477 1/20 0.32
CTSG P08311 1/20 0.32
CTRB1 P17538 1/20 0.32
CMA1 P23946 1/20 0.32
ZDHHC7 Q9NXF8 1/20 0.32
MAPT P10636 1/20 0.32
GPR84 Q9NQS5 3/20 0.32
FFAR1 O14842 1/20 0.32
FAAH O00519 1/20 0.31
CNR1 P21554 1/20 0.31
DAGLA Q9Y4D2 1/20 0.31

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
SCHEMBL28708880 0.91 PRKCA (0.38) PRKCAPRKCDCA2CA1CTSK
SCHEMBL27814887 0.88 PRKCA (0.35) PRKCAPRKCDCA2CA1CTSK
SCHEMBL3475993 0.84 PRKCA (0.44) PRKCAPRKCDCA2CA1CTSK
SCHEMBL6248755 0.81 PRKCA (0.40) PRKCAPRKCDCA2CA1CTSK
SCHEMBL120461 0.80 PRKCA (0.46) PRKCAPRKCDCA2CA1CTSK
SCHEMBL10765248 0.79 PRKCA (0.41) PRKCAPRKCDCA2CA1CTSK
SCHEMBL1068452 0.79 PRKCA (0.40) PRKCAPRKCDCA2CA1CTSK
SCHEMBL7643858 0.78 GPR84 (0.45) PRKCAPRKCDCA2MAPK1ZDHHC7
SCHEMBL7647164 0.78 GPR84 (0.45) PRKCAPRKCDCA2MAPK1ZDHHC7
SCHEMBL27810714 0.78 GPR84 (0.45) PRKCAPRKCDCA2MAPK1ZDHHC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112341787-B Bio-based resin composition, metal foil-clad laminate, and printed wiring board 南亚新材料科技股份有限公司 2022-09-20 CN disclosed
CN-112341787-A Bio-based resin composition, metal foil-clad laminate, and printed wiring board 南亚新材料科技股份有限公司 2021-02-09 CN disclosed
CN-102137892-A Flame retardant polyolefin compositions AKZO NOBEL NV 2011-07-27 CN disclosed
CN-101128489-A Process for preparing aqueous addition polymer dispersions BASF AG (DE) 2008-02-20 CN disclosed
US-6720462-B2 VIA CATALYTIC OXIDATION OF AROMATIC HYDROCARBON TO HYDROPEROXIDE WHICH IS CLEAVED TO FORM PHENOL DERVIVATIVE AND KETONE DEGUSSA AG (DE) 2004-04-13 US disclosed
US-20030083527-A1 Method for producing aromatic alcohols, especially phenol CREAVIS GESELLSCHAFT FUER TECHNOLOGY UND INNOVATION MBH (DE) 2003-05-01 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-20030083527-A1 Method for producing aromatic alcohols, especially phenol CYP2E1, AOC2, ADH1C PRKCA 2807/4885PRKCD 1807/4885CA2 2375/4885

“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.