SCHEMBL2608879

SCHEMBL2608879

CC(C)COC1CCN(Cc2ccccc2)C1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 2/20 0.58
WDR77 Q9BQA1 2/20 0.58
ACHE P22303 4/20 0.50
BCHE P06276 4/20 0.50
BACE1 P56817 3/20 0.50
HRH3 Q9Y5N1 2/20 0.49
KDM4E B2RXH2 1/20 0.48
NPC1 O15118 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
DRD2 P14416 1/20 0.47
DRD4 P21917 1/20 0.47
DRD3 P35462 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
GAA P10253 1/20 0.46
MCHR1 Q99705 2/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C19 P33261 1/20 0.46
ALDH1A1 P00352 1/20 0.46

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
SCHEMBL2614397 0.84 ACHE (0.54) PRMT5WDR77ACHEBCHEBACE1
SCHEMBL7276334 0.84 ACHE (0.54) PRMT5WDR77ACHEBCHEBACE1
SCHEMBL20008975 0.82 ACHE (0.53) PRMT5WDR77ACHEBCHEBACE1
SCHEMBL24652674 0.82 NPC1 (0.58) PRMT5WDR77ACHEBCHEBACE1
SCHEMBL3271398 0.80 LTA4H (0.60) ACHEBCHEBACE1SMN1; SMN2GAA
SCHEMBL4512639 0.80 LTA4H (0.60) ACHEBCHEBACE1SMN1; SMN2GAA
Hydrochloric Acid SCHEMBL18038825 0.79 LTA4H (0.58) ACHEBCHEBACE1SMN1; SMN2GAA
SCHEMBL11534247 0.78 PRMT5 (0.50) PRMT5WDR77ACHEBCHEBACE1
SCHEMBL11531230 0.78 BCHE (0.52) PRMT5WDR77ACHEBCHEBACE1
SCHEMBL14218548 0.77 CYP1A2 (0.55) PRMT5WDR77ACHEBCHEBACE1

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-20120101091-A1 VIRAL POLYMERASE INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-04-26 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-20120101091-A1 VIRAL POLYMERASE INHIBITORS POLR2A, POLR2H, POLR2E PRMT5 861/4885WDR77 2056/4885ACHE 3108/4885

“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.