SCHEMBL13128474

SCHEMBL13128474

CCC1CC(C)(C)CCN1C(=O)c1c(C)nn2ccccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
LMNA P02545 1/20 0.36
MIF P14174 2/20 0.35
ALDH1A1 P00352 3/20 0.35
CYP1A2 P05177 2/20 0.35
MEN1 O00255 1/20 0.35
PDE5A O76074 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
TSHR P16473 1/20 0.35
PDE4A P27815 1/20 0.35
ADORA2A P29274 1/20 0.35
ADORA1 P30542 1/20 0.35
CYP2C19 P33261 1/20 0.35
BLM P54132 1/20 0.35
KMT2A Q03164 1/20 0.35
PDE4B Q07343 1/20 0.35
PDE4C Q08493 1/20 0.35

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
SCHEMBL13127672 0.80 ALDH1A1 (0.52) ALDH1A1MEN1TSHRKMT2ANPSR1
SCHEMBL3455215 0.76 LMNA (0.53) LMNAALDH1A1MEN1KMT2ANPSR1
SCHEMBL13672182 0.70 CNR2 (0.49) L3MBTL1ALDH1A1MEN1CYP2D6TSHR
SCHEMBL956204 0.69 EGFR (0.55) L3MBTL1LMNAMIFALDH1A1CYP1A2
SCHEMBL7504827 0.69 MIF (0.51) MGLLMIFALDH1A1CYP1A2MEN1
SCHEMBL9198531 0.69 L3MBTL1 (0.62) L3MBTL1LMNAALDH1A1MEN1TSHR
SCHEMBL5848990 0.67 ALDH1A1 (0.51) MGLLL3MBTL1MIFALDH1A1CYP1A2
SCHEMBL951965 0.67 MEN1 (0.51) MGLLL3MBTL1MIFALDH1A1CYP1A2
SCHEMBL953579 0.67 MIF (0.49) L3MBTL1LMNAMIFALDH1A1CYP1A2
SCHEMBL3064344 0.66 MIF (0.51) MGLLMIFALDH1A1CYP1A2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2239012-A2 Pharmaceutical use of substituted amides High Point Pharmaceuticals, LLC (US) 2010-10-13 EP disclosed
US-20090264414-A1 Amide Derivatives and Pharmaceutical Use Thereof HIGH POINT PHARMACEUTICALS, LLC (US) 2009-10-22 US disclosed
US-20080108598-A1 Pharmaceutical use of substituted amides NOVO NORDISK A/S (DK) 2008-05-08 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 (2 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-20080108598-A1 Pharmaceutical use of substituted amides HSD11B1, HSD3B1, HSD11B2 MGLL 737/4885L3MBTL1 4434/4885LMNA 3468/4885
US-20090264414-A1 Amide Derivatives and Pharmaceutical Use Thereof HSD11B1, HSD11B2, HSD3B1 MGLL 853/4885L3MBTL1 4334/4885LMNA 3531/4885

“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.