SCHEMBL12515693

SCHEMBL12515693

CC(C)c1ccc(N)c(N2CCN(c3cnccn3)CC2)c1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
MAPT P10636 4/20 0.42
ACHE P22303 2/20 0.42
SORD Q00796 1/20 0.40
KDM4E B2RXH2 4/20 0.38
GAA P10253 1/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
RECQL P46063 1/20 0.38
PTK2B Q14289 1/20 0.38
SLC6A7 Q99884 1/20 0.37
DRD2 P14416 1/20 0.37
DRD4 P21917 1/20 0.37
DRD3 P35462 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
ALDH1A1 P00352 1/20 0.36
SMN1; SMN2 Q16637 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
SCHEMBL14200378 0.83 LMNA (0.52) LMNAL3MBTL1MAPTACHESORD
SCHEMBL15071226 0.80 LMNA (0.48) LMNAL3MBTL1MAPTSORDKDM4E
SCHEMBL15071182 0.80 L3MBTL1 (0.46) LMNAL3MBTL1MAPTACHEHTT
SCHEMBL12516747 0.80 HRH3 (0.52) LMNAL3MBTL1MAPTSORDKDM4E
SCHEMBL14206444 0.77 MAP4K4 (0.41) HRH3
SCHEMBL12515928 0.77 MAPT (0.50) LMNAL3MBTL1MAPTKDM4EGAA
SCHEMBL12516966 0.76 ALDH1A1 (0.41) LMNAL3MBTL1KDM4EGAAALDH1A1
SCHEMBL25870823 0.76 GAA (0.56) LMNAL3MBTL1MAPTKDM4EGAA
SCHEMBL15071187 0.76 VCP (0.45) LMNAL3MBTL1MAPTKDM4EGAA
SCHEMBL12516535 0.76 CYP1A2 (0.49) LMNAL3MBTL1KDM4EMAPK1ALDH1A1

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
US-20130164259-A1 1,4-SUBSTITUTED PIPERAZINE DERIVATIVES AND METHODS OF USE THEREOF SCHERING CORPORATION 2013-06-27 US disclosed
US-20130164259-A1 1,4-SUBSTITUTED PIPERAZINE DERIVATIVES AND METHODS OF USE THEREOF SCHERING CORPORATION 2013-06-27 US disclosed
WO-2011087738-A2 1,4-SUBSTITUTED PIPERAZINE DERIVATIVES AND METHODS OF USE THEREOF SCHERING CORPORATION (US) 2011-07-21 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-20130164259-A1 1,4-SUBSTITUTED PIPERAZINE DERIVATIVES AND METHODS OF USE THEREOF ZC3HAV1, BAZ2A, HAVCR2 LMNA 2722/4885L3MBTL1 1441/4885MAPT 2898/4885

“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.