SCHEMBL588342

SCHEMBL588342

CC(=O)OC1CCCCC1(O)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 7/20 0.41
CHRM3 P20309 1/20 0.41
CNR1 P21554 1/20 0.41
AKR1C1 Q04828 1/20 0.40
MAPK1 P28482 1/20 0.39
SLC18A3 Q16572 2/20 0.39
OPRM1 P35372 2/20 0.39
OPRD1 P41143 2/20 0.39
OPRK1 P41145 2/20 0.39
MEN1 O00255 1/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL5349503 0.81 MAPT (0.43) CNR2CNR1OPRM1OPRD1OPRK1
SCHEMBL14842579 0.81 CNR2 (0.40) CNR2CNR1AKR1C1OPRM1OPRD1
SCHEMBL28740691 0.75 SLC6A2 (0.41) OPRM1OPRD1OPRK1MEN1SLC6A2
SCHEMBL4813860 0.74 MEN1 (0.42) MEN1KMT2A
Cicloxilic Acid SCHEMBL11233561 0.73 CNR2 (0.46) CNR2CNR1AKR1C1MAPK1OPRM1
Cicloxilic Acid SCHEMBL866482 0.73 CNR2 (0.46) CNR2CNR1AKR1C1MAPK1OPRM1
Cicloxilic Acid SCHEMBL30436810 0.73 CNR2 (0.46) CNR2CNR1AKR1C1MAPK1OPRM1
Cicloxilic Acid SCHEMBL866481 0.73 CNR2 (0.46) CNR2CNR1AKR1C1MAPK1OPRM1
SCHEMBL11465118 0.73 MAPT (0.54) CNR2CNR1OPRM1OPRD1OPRK1
SCHEMBL9618282 0.72 SLC6A9 (0.41) MAPK1OPRM1OPRD1OPRK1MEN1

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
US-8115029-B2 Oxidizing a substrate using a catalyst of a complex of cobalt and N-hydroxysuccinimide, N-hydroxyphthalimide, or N-hydroxymaleimide; alkanes, alkenes, cycloalkanes, cycloalkenes, aromatics, aryl aldehydes, aryl carboxylic acids, benzyl alcohols UNIVERSITY OF KANSAS (US) 2012-02-14 US disclosed
US-8115029-B2 Oxidizing a substrate using a catalyst of a complex of cobalt and N-hydroxysuccinimide, N-hydroxyphthalimide, or N-hydroxymaleimide; alkanes, alkenes, cycloalkanes, cycloalkenes, aromatics, aryl aldehydes, aryl carboxylic acids, benzyl alcohols UNIVERSITY OF KANSAS (US) 2012-02-14 US disclosed
US-8115029-B2 Oxidizing a substrate using a catalyst of a complex of cobalt and N-hydroxysuccinimide, N-hydroxyphthalimide, or N-hydroxymaleimide; alkanes, alkenes, cycloalkanes, cycloalkenes, aromatics, aryl aldehydes, aryl carboxylic acids, benzyl alcohols UNIVERSITY OF KANSAS (US) 2012-02-14 US disclosed
US-20080139841-A1 Cobalt-Catalyzed Oxidations in Volumetrically Expanded Liquids by Compressed Gases UNIVERSITY OF KANSAS (US) 2008-06-12 US disclosed
US-20080139841-A1 Cobalt-Catalyzed Oxidations in Volumetrically Expanded Liquids by Compressed Gases UNIVERSITY OF KANSAS (US) 2008-06-12 US disclosed
US-20080139841-A1 Cobalt-Catalyzed Oxidations in Volumetrically Expanded Liquids by Compressed Gases UNIVERSITY OF KANSAS (US) 2008-06-12 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-20080139841-A1 Cobalt-Catalyzed Oxidations in Volumetrically Expanded Liquids by Compressed Gases HAO2, HMOX2, HAAO CNR2 353/4885CHRM3 2256/4885CNR1 1331/4885

“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.