SCHEMBL10283293

SCHEMBL10283293

COCc1ccccc1-c1cccc2c1OCCn1c-2c(C2CCCCC2)c2ccc(C=O)cc21

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 1/20 0.36
MMP12 P39900 1/20 0.36
NR1I2 O75469 1/20 0.34
PTGER4 P35408 1/20 0.32
DRD2 P14416 1/20 0.30
DRD1 P21728 1/20 0.30
DRD4 P21917 1/20 0.30
DRD5 P21918 1/20 0.30
DRD3 P35462 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
SCHEMBL773573 0.87 PRKCA (0.50) PRKCAMMP12NR1I2
SCHEMBL804595 0.81 NR1I2 (0.36) PRKCAMMP12NR1I2DRD2DRD1
SCHEMBL771845 0.76 PRKCA (0.51) PRKCAMMP12NR1I2
SCHEMBL771869 0.75 PRKCA (0.56) PRKCAMMP12NR1I2
SCHEMBL772016 0.74 PRKCA (0.47) PRKCAMMP12NR1I2
SCHEMBL10283222 0.73 PRKCA (0.48) PRKCAMMP12NR1I2
Hydrochloric Acid SCHEMBL772936 0.73 PRKCA (0.47) PRKCAMMP12NR1I2
SCHEMBL773796 0.72 PRKCA (0.47) PRKCAMMP12NR1I2
SCHEMBL804583 0.72 PRKCA (0.47) PRKCAMMP12NR1I2
SCHEMBL803702 0.72 PRKCA (0.36) PRKCAMMP12NR1I2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120070409-A1 TETRACYCLIC FUSED HETEROCYCLIC COMPOUND AND USE THEREOF AS HCV POLYMERASE INHIBITOR JAPAN TOBACCO INC. (JP) 2012-03-22 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-20120070409-A1 TETRACYCLIC FUSED HETEROCYCLIC COMPOUND AND USE THEREOF AS HCV POLYMERASE INHIBITOR POLI, TERT, ZC3HAV1 PRKCA 2404/4885MMP12 1013/4885NR1I2 1189/4885

“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.