SCHEMBL22312427

SCHEMBL22312427

O=C(O)C(CC1CCCCCCCCCC1)NP

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GRN P28799 1/20 0.50
SORT1 Q99523 1/20 0.50
CPB2 Q96IY4 11/20 0.46
LTA4H P09960 1/20 0.42
MME P08473 1/20 0.41
ACE P12821 1/20 0.41
CPA1 P15085 1/20 0.41
ACE2 Q9BYF1 1/20 0.41

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
SCHEMBL23467369 1.00 GRN (0.50) GRNSORT1CPB2LTA4HMME
SCHEMBL25010861 1.00 GRN (0.50) GRNSORT1CPB2LTA4HMME
SCHEMBL15764178 0.94 GRN (0.44) GRNSORT1CPB2LTA4HMME
SCHEMBL19371886 0.82 GRN (0.51) GRNSORT1CPB2LTA4HMME
SCHEMBL421252 0.82 GRN (0.51) GRNSORT1CPB2LTA4HMME
SCHEMBL11796323 0.82 GRN (0.51) GRNSORT1CPB2LTA4H
SCHEMBL11796335 0.82 GRN (0.51) GRNSORT1CPB2LTA4H
SCHEMBL8225317 0.81 GRN (0.57) GRNSORT1CPB2LTA4HMME
SCHEMBL805198 0.81 GRN (0.50) GRNSORT1CPB2LTA4H
SCHEMBL7566961 0.81 GRN (0.50) GRNSORT1CPB2LTA4H

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-20200247747-A1 HETEROCYCLIC COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2020-08-06 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-20200247747-A1 HETEROCYCLIC COMPOUND AND USE THEREOF HCRTR2, HCRTR1, MCHR2 GRN 3113/4885SORT1 1200/4885CPB2 2023/4885

“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.