SCHEMBL6921835

SCHEMBL6921835

CC(CO)C(C)N1CCNCC1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 1/20 0.36
CHRM3 P20309 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.34
SIGMAR1 Q99720 2/20 0.34
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
SLC6A2 P23975 4/20 0.31
SLC6A4 P31645 4/20 0.31
CYP2D6 P10635 1/20 0.31
CYP19A1 P11511 1/20 0.31
HSD17B10 Q99714 1/20 0.31
OPRD1 P41143 2/20 0.30
SLC6A3 Q01959 1/20 0.30
CHRM2 P08172 1/20 0.30
CHRM1 P11229 1/20 0.30

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
SCHEMBL6921842 1.00 CHRM5 (0.36) CHRM5CHRM3SMN1; SMN2SIGMAR1MEN1
SCHEMBL31398376 0.83 CHRM5 (0.34) CHRM5CHRM3SMN1; SMN2SIGMAR1MEN1
SCHEMBL10237646 0.82 SLC6A2 (0.33) CHRM5CHRM3SMN1; SMN2SIGMAR1MEN1
SCHEMBL20569862 0.79 HRH3 (0.37) CHRM5CHRM3SMN1; SMN2SIGMAR1MEN1
SCHEMBL15471 0.79 HRH3 (0.37) CHRM5CHRM3SMN1; SMN2SIGMAR1MEN1
Methyl Alcohol SCHEMBL27940927 0.77 HRH3 (0.36) CHRM5CHRM3SMN1; SMN2SIGMAR1MEN1
SCHEMBL9813407 0.77 HRH3 (0.36) CHRM5CHRM3SMN1; SMN2SIGMAR1MEN1
Hydrochloric Acid SCHEMBL64916 0.77 SMN1; SMN2 (0.38) CHRM5CHRM3SMN1; SMN2SIGMAR1MEN1
SCHEMBL6408772 0.76 SMN1; SMN2 (0.36) CHRM5CHRM3SMN1; SMN2SIGMAR1MEN1
SCHEMBL1969997 0.76 SMN1; SMN2 (0.36) CHRM5CHRM3SMN1; SMN2SIGMAR1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6355635-B1 IMIDAZOLEBENZENE, IMIDAZOLEPYRIDINE COMPOUNDS FOR TREATMENT OF OBESITY PFIZER INC. 2002-03-12 US claimed
US-20010039277-A1 Compounds for the treatment of obesity ELLIOTT RICHARD L (US) 2001-11-08 US claimed
WO-2000066578-A1 COMPOUNDS FOR THE TREATMENT OF OBESITY PFIZER PRODUCTS INC. (US) 2000-11-09 WO claimed
US-6514966-B2 Neuropeptide Y antagonists such as 2-chloro-5-(4-(3,4-dich loro-phenyl)-1H-imidazol-2-yl)-pyridine PFIZER INC. 2003-02-04 US disclosed
US-6355635-B1 IMIDAZOLEBENZENE, IMIDAZOLEPYRIDINE COMPOUNDS FOR TREATMENT OF OBESITY PFIZER INC. 2002-03-12 US disclosed
US-20010039277-A1 Compounds for the treatment of obesity ELLIOTT RICHARD L (US) 2001-11-08 US disclosed
WO-2000066578-A1 COMPOUNDS FOR THE TREATMENT OF OBESITY PFIZER PRODUCTS INC. (US) 2000-11-09 WO 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-20010039277-A1 Compounds for the treatment of obesity NPY1R, NPY4R, NPY2R CHRM5 731/4885CHRM3 336/4885SMN1; SMN2 3943/4885

“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.