SCHEMBL23745585

SCHEMBL23745585

Cc1cccc(C(CC(=O)NC2CCNCC2)c2cn(CC3CCOCC3)c3ccc(Br)cc23)c1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 17/20 0.46
CNR1 P21554 13/20 0.46
ICMT O60725 1/20 0.37
GRIN2B Q13224 1/20 0.35
IDO1 P14902 1/20 0.34
EPHX2 P34913 1/20 0.34

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
Hydrochloric Acid SCHEMBL23721976 0.99 CNR2 (0.45) CNR2CNR1ICMTGRIN2BIDO1
SCHEMBL23745455 0.93 IDO1 (0.40) CNR2CNR1ICMTIDO1EPHX2
Hydrochloric Acid SCHEMBL23722056 0.92 IDO1 (0.40) CNR2CNR1ICMTIDO1EPHX2
SCHEMBL23745762 0.91 CNR1 (0.43) CNR2CNR1ICMT
Hydrochloric Acid SCHEMBL23721959 0.90 CNR1 (0.42) CNR2CNR1ICMT
SCHEMBL23745552 0.90 IL1B (0.39) CNR2CNR1ICMTGRIN2BIDO1
SCHEMBL23745893 0.87 IDO1 (0.45) CNR2CNR1ICMTIDO1EPHX2
SCHEMBL23745604 0.86 CNR2 (0.42) CNR2CNR1ICMT
SCHEMBL23722118 0.86 IDO1 (0.42) CNR2CNR1ICMTGRIN2BIDO1
SCHEMBL23745572 0.85 ICMT (0.41) CNR1ICMT

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-20210246115-A1 ANTI-INFECTIVE HETEROCYCLIC COMPOUNDS AND USES THEREOF BIOIMICS AB (SE) 2021-08-12 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-20210246115-A1 ANTI-INFECTIVE HETEROCYCLIC COMPOUNDS AND USES THEREOF FDPS, FPR1, F12 CNR2 2528/4885CNR1 1651/4885ICMT 345/4885

“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.