SCHEMBL13636007

SCHEMBL13636007

CCOc1ccc(Br)cc1/C=C/C(=O)N1CCN(C2CCCC2)CC1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.47
GPR183 P32249 8/20 0.43
HPGD P15428 1/20 0.43
TSHR P16473 1/20 0.43
AR P10275 1/20 0.42
LMNA P02545 3/20 0.41
KDM4E B2RXH2 1/20 0.40
HTT P42858 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL4381584 1.00 SMN1; SMN2 (0.47) SMN1; SMN2GPR183HPGDTSHRAR
SCHEMBL14190929 0.99 SMN1; SMN2 (0.46) SMN1; SMN2GPR183HPGDTSHRAR
SCHEMBL4381901 0.99 SMN1; SMN2 (0.46) SMN1; SMN2GPR183HPGDTSHRAR
SCHEMBL13090286 0.92 SMN1; SMN2 (0.49) SMN1; SMN2GPR183HPGDTSHRAR
SCHEMBL2833291 0.92 SMN1; SMN2 (0.49) SMN1; SMN2GPR183HPGDTSHRAR
SCHEMBL3767754 0.91 GPR183 (0.41) SMN1; SMN2GPR183HPGDTSHRAR
SCHEMBL3767758 0.91 GPR183 (0.41) SMN1; SMN2GPR183HPGDTSHRAR
SCHEMBL14218062 0.84 GPR183 (0.61) SMN1; SMN2GPR183HPGDTSHRAR
SCHEMBL14190909 0.82 GPR183 (0.55) SMN1; SMN2GPR183HPGDTSHRAR
SCHEMBL4378984 0.82 GPR183 (0.55) SMN1; SMN2GPR183HPGDTSHRAR

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 SMN1; SMN2 2684/4885GPR183 264/4885HPGD 646/4885

“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.