SCHEMBL14218059

SCHEMBL14218059

CCN1CCN(C(=O)CSc2ccc3ccccc3c2)CC1

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.67
RAB9A P51151 2/20 0.67
MEN1 O00255 1/20 0.67
KDM4E B2RXH2 2/20 0.65
MAPT P10636 2/20 0.65
L3MBTL1 Q9Y468 2/20 0.65
GAA P10253 1/20 0.65
ATM Q13315 1/20 0.65
TDP1 Q9NUW8 1/20 0.65
HPGD P15428 3/20 0.54
LMNA P02545 3/20 0.54
HTT P42858 1/20 0.54
ALDH1A1 P00352 2/20 0.52
HSD11B1 P28845 1/20 0.51
NPC1 O15118 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.49
ANPEP P15144 1/20 0.49
HRH4 Q9H3N8 1/20 0.47
FKBP1A P62942 1/20 0.47

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
SCHEMBL4377257 0.84 RAB9A (0.75) KMT2ARAB9AMEN1KDM4EMAPT
SCHEMBL2377627 0.80 KMT2A (0.77) KMT2ARAB9AMEN1KDM4EHPGD
SCHEMBL4378474 0.79 KDM4E (0.61) KMT2ARAB9AKDM4EMAPTL3MBTL1
SCHEMBL16578041 0.78 HSD11B1 (0.69) KMT2AMEN1KDM4ELMNAALDH1A1
SCHEMBL4380926 0.78 KDM4E (0.60) KMT2ARAB9AKDM4EMAPTL3MBTL1
SCHEMBL4377583 0.78 MAPT (0.77) KDM4EMAPTL3MBTL1GAAATM
SCHEMBL4379070 0.77 KDM4E (0.76) KMT2ARAB9AMEN1KDM4EMAPT
SCHEMBL2836574 0.76 L3MBTL1 (0.58) KMT2ARAB9AKDM4EMAPTL3MBTL1
SCHEMBL9950430 0.73 PKM (0.70) KMT2ARAB9AMEN1KDM4EMAPT
SCHEMBL14218007 0.73 ALDH1A1 (0.52) KMT2ARAB9AMEN1KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080113968-A1 Substituted piperazines and diazepanes NOVO NORDISK A/S (DK) 2008-05-15 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-20080113968-A1 Substituted piperazines and diazepanes HRH3, HRH4, HRH1 KMT2A 295/4885RAB9A 3209/4885MEN1 2570/4885

“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.