SCHEMBL13636352

SCHEMBL13636352

CCCN1CCN(C(=O)/C=C/c2ccccc2Cl)CC1

nearest known ligand 0.69

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.69
L3MBTL1 Q9Y468 2/20 0.69
F2R P25116 2/20 0.65
KMT2A Q03164 3/20 0.57
POLB P06746 3/20 0.55
APP P05067 1/20 0.54
MEN1 O00255 2/20 0.54
ALDH1A1 P00352 2/20 0.54
TDP1 Q9NUW8 1/20 0.54
GPR183 P32249 2/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C19 P33261 1/20 0.50
RAB9A P51151 1/20 0.48
GAA P10253 1/20 0.48
LMNA P02545 1/20 0.47
ATM Q13315 1/20 0.47
KEAP1 Q14145 1/20 0.47
NFE2L2 Q16236 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
SCHEMBL4379116 1.00 MAPT (0.69) MAPTL3MBTL1F2RKMT2APOLB
SCHEMBL13635997 0.86 KMT2A (0.55) MAPTL3MBTL1F2RKMT2APOLB
SCHEMBL4379006 0.86 KMT2A (0.55) MAPTL3MBTL1F2RKMT2APOLB
SCHEMBL4375996 0.86 APP (0.55) MAPTL3MBTL1F2RKMT2APOLB
SCHEMBL13636157 0.86 APP (0.55) MAPTL3MBTL1F2RKMT2APOLB
SCHEMBL2908578 0.85 F2R (0.66) MAPTL3MBTL1F2RKMT2APOLB
SCHEMBL13636223 0.85 RAB9A (0.67) MAPTL3MBTL1F2RKMT2APOLB
SCHEMBL4377877 0.85 RAB9A (0.67) MAPTL3MBTL1F2RKMT2APOLB
SCHEMBL2903103 0.84 F2R (0.82) MAPTL3MBTL1F2RKMT2APOLB
SCHEMBL10300780 0.83 F2R (0.82) MAPTL3MBTL1F2RKMT2APOLB

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 MAPT 1441/4885L3MBTL1 4039/4885F2R 347/4885

“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.