SCHEMBL23745536

SCHEMBL23745536

Cc1cccc(C(CC(N)=O)c2cn(CC3CCCCC3)c3ccccc23)c1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ICMT O60725 4/20 0.47
CNR1 P21554 7/20 0.46
MAPT P10636 2/20 0.41
TPSAB1 Q15661 1/20 0.40
CNR2 P34972 1/20 0.40
PDE4A P27815 3/20 0.39
PDE4B Q07343 3/20 0.39
PDE4C Q08493 3/20 0.39
PDE4D Q08499 3/20 0.39
MGAM O43451 1/20 0.39
GAA P10253 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 1/20 0.39
NPC1 O15118 1/20 0.39
PADI4 Q9UM07 1/20 0.39

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 SCHEMBL23722177 0.99 ICMT (0.46) ICMTCNR1MAPTTPSAB1CNR2
SCHEMBL22439066 0.92 CNR1 (0.47) ICMTCNR1MAPTTPSAB1CNR2
SCHEMBL22439554 0.88 CNR1 (0.43) ICMTCNR1MAPTTPSAB1CNR2
SCHEMBL23722152 0.87 KMT2A (0.46) CNR1MAPTCNR2
SCHEMBL23745813 0.87 CNR1 (0.44) ICMTCNR1MAPTTPSAB1GAA
SCHEMBL23745723 0.86 CNR1 (0.44) ICMTCNR1MAPTTPSAB1GAA
Hydrochloric Acid SCHEMBL23721919 0.86 CNR1 (0.44) ICMTCNR1MAPTTPSAB1GAA
SCHEMBL23745821 0.86 CNR1 (0.41) ICMTCNR1MAPTCNR2
SCHEMBL23745575 0.85 CNR1 (0.42) ICMTCNR1MAPT
SCHEMBL23721885 0.85 CNR1 (0.42) ICMTCNR1MAPT

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 ICMT 345/4885CNR1 1651/4885MAPT 4743/4885

“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.