SCHEMBL4034725

SCHEMBL4034725

NC(=O)C1CCCN(C2CC2)C1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.51
DPP4 P27487 3/20 0.49
DPP9 Q86TI2 3/20 0.49
DPP7 Q9UHL4 3/20 0.49
DPP8 Q6V1X1 2/20 0.49
MAPK1 P28482 1/20 0.46
BCHE P06276 1/20 0.46
LMNA P02545 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
GAA P10253 2/20 0.44
GLA P06280 1/20 0.44
HSD17B10 Q99714 1/20 0.44
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
KDM2B Q8NHM5 3/20 0.41

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
SCHEMBL17895154 0.94 ALDH1A1 (0.46) ALDH1A1DPP4DPP9DPP7DPP8
SCHEMBL2449861 0.92 ALDH1A1 (0.49) ALDH1A1DPP4DPP9DPP7DPP8
SCHEMBL2450630 0.91 ALDH1A1 (0.49) ALDH1A1DPP4DPP9DPP7DPP8
SCHEMBL5912608 0.87 KMT2A (0.46) ALDH1A1DPP4DPP9DPP7DPP8
SCHEMBL15422012 0.87 CHRM1 (0.49) ALDH1A1DPP4DPP9DPP7DPP8
Hydrochloric Acid SCHEMBL2146257 0.85 CHRM1 (0.47) ALDH1A1DPP4DPP9DPP7DPP8
SCHEMBL16695086 0.83 CHRM1 (0.46) ALDH1A1DPP4DPP9DPP7DPP8
SCHEMBL8439278 0.82 ALDH1A1 (0.51) ALDH1A1DPP4DPP9DPP7DPP8
Hydrochloric Acid SCHEMBL2146017 0.82 CHRM1 (0.45) ALDH1A1DPP4DPP9DPP7DPP8
Hydrochloric Acid SCHEMBL28435313 0.81 KDM2B (0.47) ALDH1A1DPP4DPP9DPP7DPP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2035409-A1 BENZIMIDAZOLE DERIVATIVES WHICH ARE TO BE USED AS ANATGONIST FOR THE CB1-RECEPTOR AstraZeneca AB (SE) 2009-03-18 EP claimed
WO-2007145563-A1 BENZIMIDAZOLE DERIVATIVES WHICH ARE TO BE USED AS ANTAGONIST FOR THE CB1-RECEPTOR ASTRAZENECA AB (SE) 2007-12-21 WO claimed
US-9115133-B2 Substituted fused tricyclic compounds, compositions and medicinal applications thereof ADVINUS THERAPEUTICS LIMITED (US) 2015-08-25 US disclosed
US-20140023614-A1 SUBSTITUTED FUSED TRICYCLIC COMPOUNDS, COMPOSITIONS AND MEDICINAL APPLICATIONS THEREOF ADVINUS THERAPEUTICS LTD. 2014-01-23 US disclosed
WO-2008036021-A1 TETRAHYDRO-LH-PYRIDO [3,4 -B] INDOLE DERIVATIVES AS CBL RECEPTOR LIGANDS ASTRAZENECA AB (SE) 2008-03-27 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-20140023614-A1 SUBSTITUTED FUSED TRICYCLIC COMPOUNDS, COMPOSITIONS AND MEDICINAL APPLICATIONS THEREOF MALT1, JAK1, ICOS ALDH1A1 1930/4885DPP4 703/4885DPP9 902/4885

“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.