SCHEMBL23745634

SCHEMBL23745634

Cc1cccc(C(CC(=O)NCCC2CCNCC2)c2cn(CC3CCCCC3)c3ccc(Br)cc23)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 6/20 0.36
ICMT O60725 1/20 0.36
ABCC2 Q92887 1/20 0.35
CNR2 P34972 2/20 0.35
ITGB3 P05106 3/20 0.35
ITGA2B P08514 3/20 0.35
BCHE P06276 1/20 0.34
ACHE P22303 1/20 0.34
HPGD P15428 2/20 0.34
MEN1 O00255 1/20 0.34
LMNA P02545 1/20 0.34
TP53 P04637 1/20 0.34
KMT2A Q03164 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
IDO1 P14902 1/20 0.34
EPHX2 P34913 1/20 0.34
GLA P06280 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MAPK8 P45983 1/20 0.33
CACNA2D1 P54289 1/20 0.33

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 SCHEMBL23722024 0.99 CNR1 (0.36) CNR1ICMTABCC2CNR2ITGB3
SCHEMBL23745657 0.91 CNR1 (0.40) CNR1ICMTCNR2ITGB3ITGA2B
SCHEMBL23745824 0.91 CNR1 (0.42) CNR1ICMTITGB3ITGA2BBCHE
Hydrochloric Acid SCHEMBL23721970 0.91 CNR1 (0.41) CNR1ICMTCNR2ITGB3ITGA2B
Hydrochloric Acid SCHEMBL23722072 0.90 CNR1 (0.42) CNR1ICMTITGB3ITGA2BBCHE
SCHEMBL23745455 0.89 IDO1 (0.40) CNR1ICMTABCC2CNR2HPGD
Hydrochloric Acid SCHEMBL23722056 0.88 IDO1 (0.40) CNR1ICMTABCC2CNR2HPGD
SCHEMBL23745574 0.87 ICMT (0.40) CNR1ICMTITGB3ITGA2BBCHE
Hydrochloric Acid SCHEMBL23721873 0.86 ICMT (0.39) CNR1ICMTITGB3ITGA2BBCHE
SCHEMBL23745794 0.86 MAPT (0.40) CNR1CNR2ITGB3ITGA2BBCHE

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 CNR1 1651/4885ICMT 345/4885ABCC2 715/4885

“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.