SCHEMBL14218064

SCHEMBL14218064

CCN1CCN(C(=O)/C=C\c2ccc(N(C)C)cc2)CC1

nearest known ligand 0.71

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR183 P32249 5/20 0.71
ALDH1A1 P00352 2/20 0.65
SMN1; SMN2 Q16637 1/20 0.65
TDP1 Q9NUW8 2/20 0.60
KMT2A Q03164 3/20 0.59
MEN1 O00255 2/20 0.59
KDM4E B2RXH2 1/20 0.59
HSD17B3 P37058 1/20 0.56
MAPT P10636 1/20 0.52
GAA P10253 1/20 0.50
BCHE P06276 1/20 0.50
MAOA P21397 1/20 0.50
ACHE P22303 1/20 0.50
MAOB P27338 1/20 0.50

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
SCHEMBL13636161 0.86 GPR183 (0.57) GPR183ALDH1A1SMN1; SMN2TDP1KMT2A
SCHEMBL4377423 0.86 GPR183 (0.57) GPR183ALDH1A1SMN1; SMN2TDP1KMT2A
SCHEMBL16598797 0.83 GPR183 (1.00) GPR183ALDH1A1SMN1; SMN2TDP1KMT2A
SCHEMBL16598795 0.83 GPR183 (1.00) GPR183ALDH1A1SMN1; SMN2TDP1KMT2A
SCHEMBL27295942 0.83 GPR183 (0.74) GPR183ALDH1A1SMN1; SMN2TDP1KMT2A
SCHEMBL1612931 0.82 HSD17B3 (0.61) GPR183ALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL1612928 0.82 HSD17B3 (0.61) GPR183ALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL2485549 0.78 GPR183 (0.67) GPR183ALDH1A1SMN1; SMN2TDP1KMT2A
SCHEMBL13636003 0.78 GPR183 (0.57) GPR183ALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL4380647 0.78 GPR183 (0.57) GPR183ALDH1A1SMN1; SMN2KMT2AMEN1

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 GPR183 264/4885ALDH1A1 1907/4885SMN1; SMN2 2684/4885

“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.