SCHEMBL12425844

SCHEMBL12425844

CC1CCN(C(=O)C2CCCN(C)C2)CC1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.51
HTT P42858 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.46
ALDH1A1 P00352 5/20 0.46
TSHR P16473 1/20 0.46
POLB P06746 2/20 0.44
MAPK1 P28482 1/20 0.43
USP2 O75604 1/20 0.42
HPGD P15428 1/20 0.41
GAA P10253 1/20 0.41
NPC1 O15118 1/20 0.41
ACHE P22303 1/20 0.40

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
SCHEMBL12424259 0.89 NAMPT (0.45) LMNAHTTSMN1; SMN2ALDH1A1TSHR
SCHEMBL12108433 0.87 LMNA (0.61) LMNAHTTSMN1; SMN2ALDH1A1TSHR
SCHEMBL3436956 0.86 LMNA (0.69) LMNAHTTSMN1; SMN2ALDH1A1TSHR
SCHEMBL13923290 0.86 LMNA (0.64) LMNAHTTSMN1; SMN2ALDH1A1TSHR
SCHEMBL22874778 0.83 LMNA (0.49) LMNAHTTSMN1; SMN2ALDH1A1TSHR
SCHEMBL12384643 0.82 LMNA (0.47) LMNAHTTSMN1; SMN2ALDH1A1TSHR
SCHEMBL13923289 0.81 CHRNB2 (0.59) LMNAHTTSMN1; SMN2ALDH1A1TSHR
SCHEMBL4198735 0.81 LMNA (0.50) LMNAHTTSMN1; SMN2ALDH1A1TSHR
SCHEMBL8916596 0.81 MAPK1 (0.64) LMNAHTTSMN1; SMN2ALDH1A1TSHR
SCHEMBL3990839 0.81 LMNA (0.50) LMNAHTTSMN1; SMN2ALDH1A1TSHR

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-8461328-B2 Tricyclic heterocyclic compounds, compositions and methods of use thereof GENENTECH, INC. (US) 2013-06-11 US disclosed
US-20110201593-A1 TRICYCLIC HETEROCYCLIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2011-08-18 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-20110201593-A1 TRICYCLIC HETEROCYCLIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF CCNY, CCNA1, CCNA2 LMNA 1043/4885HTT 2128/4885SMN1; SMN2 4086/4885

“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.