SCHEMBL4244062

SCHEMBL4244062

COc1ccc(N(CC2C3CCC2CN(Cc2ccccc2)C3)C(=O)O)cc1OC

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.48
LMNA P02545 1/20 0.47
ACHE P22303 2/20 0.46
KDM4E B2RXH2 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
ALDH1A1 P00352 1/20 0.46
CHRM5 P08912 1/20 0.44
CHRM1 P11229 1/20 0.44
CHRM3 P20309 1/20 0.44
S1PR1 P21453 1/20 0.43
S1PR5 Q9H228 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
CCR5 P51681 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
SCHEMBL4238450 0.82 MEN1 (0.41) SIGMAR1ACHEKDM4EALDH1A1
SCHEMBL4249819 0.81 S1PR5 (0.44) ACHECHRM3S1PR5
SCHEMBL4250520 0.80 MEN1 (0.44) SIGMAR1LMNAACHES1PR1S1PR5
SCHEMBL4242086 0.80 MEN1 (0.42) SIGMAR1LMNAACHEKDM4EL3MBTL1
SCHEMBL5833430 0.78 SIGMAR1 (0.43) SIGMAR1ACHECHRM3
SCHEMBL4242012 0.77 ACHE (0.45) SIGMAR1ACHEKDM4EALDH1A1CHRM3
SCHEMBL4237568 0.77 KDM4E (0.42) SIGMAR1LMNAKDM4EALDH1A1CHRM3
SCHEMBL4244127 0.77 KMT2A (0.45) SIGMAR1LMNAACHEKDM4EALDH1A1
SCHEMBL4249836 0.74 GRIN2B (0.40) SIGMAR1ACHECHRM3S1PR1S1PR5
SCHEMBL4250524 0.73 ACHE (0.43) ACHECHRM5CHRM1CHRM3NPC1

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 SIGMAR1 317/4885LMNA 3515/4885ACHE 108/4885

“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.