SCHEMBL4237484

SCHEMBL4237484

[CH2]C12CC1CN(Cc1ccccc1)C2

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.46
FUCA1 P04066 2/20 0.45
GAA P10253 1/20 0.42
ACHE P22303 1/20 0.41
CYP3A4 P08684 2/20 0.41
ALDH1A1 P00352 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C19 P33261 1/20 0.41
KDM4E B2RXH2 1/20 0.40
MAPT P10636 1/20 0.40
HTT P42858 1/20 0.40
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL23478565 0.77 FUCA1 (0.49) SIGMAR1FUCA1ACHEALDH1A1MAPT
SCHEMBL15939078 0.77 FUCA1 (0.49) SIGMAR1FUCA1ACHEALDH1A1MAPT
SCHEMBL1190231 0.77 SIGMAR1 (0.46) SIGMAR1FUCA1GAAACHECYP3A4
SCHEMBL4237488 0.77 GAA (0.54) SIGMAR1FUCA1GAAACHE
SCHEMBL11471422 0.75 SIGMAR1 (0.44) SIGMAR1FUCA1ALDH1A1MAPT
SCHEMBL4482745 0.74 FUCA1 (0.46) SIGMAR1FUCA1GAAALDH1A1
Hydrochloric Acid SCHEMBL11074721 0.74 POLB (0.45) SIGMAR1FUCA1
SCHEMBL31325224 0.74 FUCA1 (0.46) SIGMAR1FUCA1GAAALDH1A1
SCHEMBL3988127 0.74 SIGMAR1 (0.43) SIGMAR1FUCA1GAAACHECYP3A4
SCHEMBL15939000 0.74 GAA (0.44) SIGMAR1FUCA1GAAACHECYP3A4

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-20090012116-A1 Muscarinic Receptor Antagonists RANBAXY LABORATORIES LIMITED (IN) 2009-01-08 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-20090012116-A1 Muscarinic Receptor Antagonists CHRM3, CHRM2, CHRM5 SIGMAR1 317/4885FUCA1 1256/4885GAA 1523/4885

“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.