SCHEMBL3583500

SCHEMBL3583500

CCCOC1CCC(C)(N2CCC(NC(=O)O)CC2)CC1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 12/20 0.47
CHRM5 P08912 12/20 0.47
CHRM1 P11229 12/20 0.47
CHRM3 P20309 11/20 0.47
CHRM2 P08172 10/20 0.47
EPHX2 P34913 3/20 0.36
CCR5 P51681 3/20 0.35
MMP1 P03956 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL4572985 0.84 CHRM2 (0.42) CHRM4CHRM5CHRM1CHRM3CHRM2
SCHEMBL607715 0.82 CHRM2 (0.43) CHRM4CHRM5CHRM1CHRM3CHRM2
SCHEMBL25389501 0.80 CCR5 (0.44) EPHX2CCR5
SCHEMBL601738 0.77 CHRM1 (0.38) CHRM1EPHX2MEN1KMT2A
SCHEMBL601739 0.77 CHRM1 (0.38) CHRM1EPHX2MEN1KMT2A
SCHEMBL3016744 0.77 CHRM1 (0.38) CHRM1EPHX2MEN1KMT2A
SCHEMBL601962 0.76 CHRM4 (0.48) CHRM4CHRM5CHRM1CHRM3CHRM2
SCHEMBL600591 0.76 CHRM4 (0.48) CHRM4CHRM5CHRM1CHRM3CHRM2
SCHEMBL600590 0.76 CHRM4 (0.48) CHRM4CHRM5CHRM1CHRM3CHRM2
SCHEMBL605131 0.76 CHRM4 (0.42) CHRM4CHRM5CHRM1CHRM3CHRM2

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
EP-2004182-B1 BENZIMIDAZOLES WHICH HAVE ACTIVITY AT M1 RECEPTOR AND THEIR USES IN MEDICINE GLAXO GROUP LTD (GB) 2013-05-08 EP disclosed
US-20100280071-A1 BENZIMIDAZOLES WHICH HAVE ACTIVITY AT M1 RECEPTOR AND THEIR USES IN MEDICINE GLAXO GROUP LIMITED (GB) 2010-11-04 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-20100280071-A1 BENZIMIDAZOLES WHICH HAVE ACTIVITY AT M1 RECEPTOR AND THEIR USES IN MEDICINE CHRM1, CHRM2, CHRM4 CHRM4 3/4885CHRM5 4/4885CHRM1 1/4885

“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.