SCHEMBL4884715

SCHEMBL4884715

CCNC1C2CN(Cc3ccccc3)CC21

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FUCA1 P04066 2/20 0.49
SIGMAR1 Q99720 1/20 0.46
ACHE P22303 3/20 0.45
BCHE P06276 2/20 0.45
BACE1 P56817 2/20 0.45
HTR4 Q13639 1/20 0.44
ALDH1A1 P00352 1/20 0.44
KDM1A O60341 1/20 0.43
MC4R P32245 1/20 0.43
S1PR1 P21453 1/20 0.43
S1PR5 Q9H228 1/20 0.43

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
SCHEMBL31211096 0.85 ACHE (0.47) FUCA1SIGMAR1ACHEBCHEBACE1
SCHEMBL4619365 0.83 FUCA1 (0.51) FUCA1SIGMAR1ACHEBCHEBACE1
SCHEMBL13102792 0.83 FUCA1 (0.51) FUCA1SIGMAR1ACHEBCHEBACE1
SCHEMBL1814808 0.83 ACHE (0.55) FUCA1SIGMAR1ACHEBCHEBACE1
SCHEMBL13117177 0.82 FUCA1 (0.42) FUCA1SIGMAR1ACHEBCHEBACE1
SCHEMBL16759827 0.80 FUCA1 (0.64) FUCA1SIGMAR1ACHEALDH1A1MC4R
SCHEMBL16775256 0.80 FUCA1 (0.64) FUCA1SIGMAR1ACHEALDH1A1MC4R
SCHEMBL19700424 0.79 HTR4 (0.49) FUCA1SIGMAR1ACHEHTR4ALDH1A1
SCHEMBL8259127 0.79 FUCA1 (0.47) FUCA1SIGMAR1ACHEBCHEBACE1
SCHEMBL4898687 0.78 HTR4 (0.54) FUCA1SIGMAR1HTR4S1PR1S1PR5

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170355708-A1 POTASSIUM CHANNEL MODULATORS CADENT THERAPEUTICS, INC. 2017-12-14 US disclosed
US-20080319043-A1 3,6-Disubstituted Azabicyclo (3.1.0) Hexane Derivatives as Muscarinic Receptor Antagonists RANBAXY LABORATORIES LIMITED (IN) 2008-12-25 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 (2 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-20170355708-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 FUCA1 2221/4885SIGMAR1 1759/4885ACHE 1647/4885
US-20080319043-A1 3,6-Disubstituted Azabicyclo (3.1.0) Hexane Derivatives as Muscarinic Receptor Antagonists CHRM3, CHRM5, CHRM2 FUCA1 3050/4885SIGMAR1 848/4885ACHE 54/4885

“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.