SCHEMBL13636191

SCHEMBL13636191

CCCN1CCN(C(=O)/C=C/c2ccc(F)cc2)CC1

nearest known ligand 0.68

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.68
LMNA P02545 1/20 0.68
TP53 P04637 1/20 0.68
GPR183 P32249 11/20 0.65
GAA P10253 1/20 0.57
SMN1; SMN2 Q16637 2/20 0.55
KMT2A Q03164 2/20 0.54
ACHE P22303 1/20 0.54
MEN1 O00255 1/20 0.53

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
SCHEMBL4384170 1.00 ALDH1A1 (0.68) ALDH1A1LMNATP53GPR183GAA
SCHEMBL14190905 0.88 GPR183 (0.67) ALDH1A1GPR183GAASMN1; SMN2KMT2A
SCHEMBL4380512 0.88 GPR183 (0.67) ALDH1A1GPR183GAASMN1; SMN2KMT2A
SCHEMBL13636478 0.86 GPR183 (0.85) GPR183
SCHEMBL4377314 0.86 GPR183 (0.85) GPR183
SCHEMBL13636347 0.85 GPR183 (0.64) ALDH1A1LMNATP53GPR183GAA
SCHEMBL4375408 0.84 ALDH1A1 (0.67) ALDH1A1LMNAGPR183GAASMN1; SMN2
SCHEMBL14190910 0.84 ALDH1A1 (0.67) ALDH1A1LMNAGPR183GAASMN1; SMN2
SCHEMBL14190907 0.84 GPR183 (0.62) ALDH1A1GPR183GAASMN1; SMN2KMT2A
SCHEMBL4383718 0.84 GPR183 (0.62) ALDH1A1GPR183GAASMN1; SMN2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1421071-B1 SUBSTITUTED PIPERAZINE AND DIAZEPANE DERIVAIVES AS HISTAMINE H3 RECEPTOR MODULATORS HIGH POINT PHARMACEUTICALS LLC (US) 2009-11-18 EP disclosed
US-20080113968-A1 Substituted piperazines and diazepanes NOVO NORDISK A/S (DK) 2008-05-15 US disclosed
US-20080113968-A1 Substituted piperazines and diazepanes NOVO NORDISK A/S (DK) 2008-05-15 US disclosed
US-7208497-B2 Substituted piperazines and diazepanes NOVO NORDISK A/S (DK) 2007-04-24 US disclosed
US-7208497-B2 Substituted piperazines and diazepanes NOVO NORDISK A/S (DK) 2007-04-24 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 ALDH1A1 1907/4885LMNA 4304/4885TP53 3881/4885

“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.