SCHEMBL4909653

SCHEMBL4909653

CCC1CC(NCC(O)C(O)(c2ccccc2)c2ccccc2)CCN1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 2/20 0.39
CHRM3 P20309 4/20 0.36
CHRM2 P08172 1/20 0.36
CHRM1 P11229 1/20 0.36
NPY2R P49146 1/20 0.35
TACR1 P25103 4/20 0.34
ABHD11 Q8NFV4 1/20 0.34
DAGLA Q9Y4D2 1/20 0.34
MAPT P10636 2/20 0.34
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
MITF O75030 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPK1 P28482 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
ADRB2 P07550 1/20 0.34
ADRB1 P08588 1/20 0.34
ADRB3 P13945 1/20 0.34

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
SCHEMBL4883020 0.72 BCHE (0.59) MAPTKDM4EMEN1MITFALDH1A1
SCHEMBL4882115 0.66 SSTR4 (0.39) SSTR4CHRM3KDM4EMEN1ALDH1A1
SCHEMBL25229505 0.63 DRD2 (0.54) MEN1KMT2A
SCHEMBL416117 0.63 GRIN1 (0.50) KDM4EMEN1ALDH1A1MAPK1KMT2A
SCHEMBL4882920 0.62 FUCA1 (0.41)
SCHEMBL4883173 0.61 GAA (0.58) CHRM3CHRM2CHRM1KDM4EMEN1
SCHEMBL11888594 0.61 MEN1 (0.60) CHRM3CHRM2CHRM1MEN1KMT2A
SCHEMBL4889924 0.61 KDM4E (0.58) CHRM3CHRM2CHRM1KDM4EMEN1
SCHEMBL31269966 0.60 KDM4E (0.61) CHRM2CHRM1KDM4EMAPK1ADRB2
SCHEMBL28747726 0.60 CARM1 (0.44) TACR1

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-20080280883-A1 Muscarinic Receptor Antagonists RANBAXY LABORATORIES LIMITED (IN) 2008-11-13 US claimed

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-20080280883-A1 Muscarinic Receptor Antagonists CHRM3, CHRM5, CHRM2 SSTR4 478/4885CHRM3 1/4885CHRM2 3/4885

“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.