SCHEMBL22651671

SCHEMBL22651671

CCCc1ccc(C2CCOCC2)cn1

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MBOAT4 Q96T53 1/20 0.40
PRMT5 O14744 5/20 0.38
KCNH2 Q12809 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35

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
SCHEMBL22502736 0.87 PRMT5 (0.39) MBOAT4PRMT5KCNH2HRH3
SCHEMBL17825442 0.81 DDB1 (0.42) MBOAT4
SCHEMBL24323890 0.81 PRMT5 (0.41) MBOAT4PRMT5KCNH2HRH3
SCHEMBL29515354 0.81 PRMT5 (0.41) MBOAT4PRMT5KCNH2HRH3
Hydrochloric Acid SCHEMBL17825460 0.80 DDB1 (0.41) MBOAT4
SCHEMBL23114391 0.78 PRMT5 (0.38) MBOAT4PRMT5
SCHEMBL22384243 0.76 DRD2 (0.36) PRMT5HRH3
SCHEMBL19088565 0.75 TNKS (0.43) KCNH2HRH3
SCHEMBL17675631 0.75 PRMT5 (0.40) MBOAT4PRMT5
SCHEMBL15805581 0.74 MBOAT4 (0.43) MBOAT4HRH3

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-20200354408-A1 ANTHELMINTIC DEPSIPEPTIDE COMPOUNDS Boehringer Ingelheim Animal Health USA Inc. (US) 2020-11-12 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-20200354408-A1 ANTHELMINTIC DEPSIPEPTIDE COMPOUNDS VIP, PREP, DNPEP MBOAT4 3796/4885PRMT5 998/4885KCNH2 2864/4885

“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.