SCHEMBL6074173

SCHEMBL6074173

CCC(C)CC(NCc1ccc(N2CCC(=O)CC2)cc1)C(=O)OC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.39
GAA P10253 2/20 0.39
MAPT P10636 2/20 0.39
ALOX15 P16050 2/20 0.39
TSHR P16473 2/20 0.39
ALOX12 P18054 2/20 0.39
MAPK1 P28482 2/20 0.39
HTT P42858 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
GFER P55789 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
LMNA P02545 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
POLB P06746 1/20 0.39
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HSP90AA1 P07900 1/20 0.36
HSP90AB1 P08238 1/20 0.36
KMT2A Q03164 1/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL6986486 0.82 TAS1R3 (0.49) KDM4EMAPTALOX15SMN1; SMN2L3MBTL1
SCHEMBL7242058 0.74 CTSL (0.47) KDM4EGAAMAPTGFERSMN1; SMN2
SCHEMBL6074806 0.73 TAS1R3 (0.57) CTSK
SCHEMBL2375727 0.70 POLB (0.57) KDM4EGAAMAPTGFERSMN1; SMN2
SCHEMBL2375734 0.70 POLB (0.57) KDM4EGAAMAPTGFERSMN1; SMN2
SCHEMBL6074166 0.69 SMN1; SMN2 (0.39) KDM4EGAAMAPTALOX15TSHR
SCHEMBL6074178 0.69 SMN1; SMN2 (0.39) KDM4EGAAMAPTALOX15TSHR
SCHEMBL27580845 0.68 NPY2R (0.41) KDM4EGAAMAPTALOX15SMN1; SMN2
SCHEMBL6075180 0.68 SMYD3 (0.41) KDM4EGAAMAPTALOX15SMN1; SMN2
SCHEMBL6074380 0.68 POLB (0.61) KDM4EGAAGFERLMNAPOLB

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-7022716-B2 Cyclic amine phenyl beta-3 adrenergic receptor agonists WYETH (US) 2006-04-04 US disclosed
US-20030144326-A1 Cyclic amine phenyl beta-3 adrenergic receptor agonists WYETH 2003-07-31 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-20030144326-A1 Cyclic amine phenyl beta-3 adrenergic receptor agonists ADRB1, ADRB3, ADRB2 KDM4E 4266/4885GAA 1992/4885MAPT 565/4885

“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.