SCHEMBL4249818

SCHEMBL4249818

Cc1ccc(C(=O)c2ccccc2N(CC2C3CCC2CN(Cc2ccccc2)C3)C(=O)O)cc1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.41
OPRM1 P35372 1/20 0.41
OPRD1 P41143 1/20 0.41
GRIN2B Q13224 1/20 0.40
TP53 P04637 1/20 0.40
ACHE P22303 2/20 0.39
BACE1 P56817 2/20 0.39
CHRM2 P08172 1/20 0.39
CHRM1 P11229 1/20 0.39
CHRM3 P20309 1/20 0.39
S1PR1 P21453 1/20 0.38
S1PR5 Q9H228 1/20 0.38
AKR1C3 P42330 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPK1 P28482 1/20 0.38
BCHE P06276 1/20 0.38
MAPT P10636 1/20 0.37

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
SCHEMBL4244157 0.93 GRIN2B (0.41) OPRM1OPRD1GRIN2BACHECHRM2
SCHEMBL4248188 0.85 ACHE (0.42) ACHEBACE1CHRM2CHRM1CHRM3
SCHEMBL4244127 0.83 KMT2A (0.45) GRIN2BACHECHRM2CHRM3ALDH1A1
SCHEMBL4249836 0.80 GRIN2B (0.40) GRIN2BACHEBACE1CHRM2CHRM3
SCHEMBL4237568 0.77 KDM4E (0.42) OPRM1GRIN2BCHRM2CHRM3ALDH1A1
SCHEMBL4238209 0.76 PKM (0.42) ACHEBACE1CHRM2CHRM3S1PR1
SCHEMBL4238450 0.75 MEN1 (0.41) GRIN2BACHEBACE1ALDH1A1BCHE
SCHEMBL4237268 0.75 MEN1 (0.42) ACHES1PR1S1PR5ALDH1A1MAPT
SCHEMBL4242012 0.75 ACHE (0.45) ACHECHRM2CHRM3S1PR1S1PR5
SCHEMBL4248181 0.75 ACHE (0.38) GAAGRIN2BACHES1PR1S1PR5

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-20090012116-A1 Muscarinic Receptor Antagonists RANBAXY LABORATORIES LIMITED (IN) 2009-01-08 US claimed
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 GAA 1523/4885OPRM1 48/4885OPRD1 185/4885

“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.