SCHEMBL1787136

SCHEMBL1787136

CNC(=O)C1CCN(C(=O)c2ccc3c(c2)CCN(C2CCC2)CC3)CC1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 7/20 0.56
ALDH1A1 P00352 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
L3MBTL3 Q96JM7 10/20 0.50
L3MBTL1 Q9Y468 9/20 0.50
KDM2B Q8NHM5 2/20 0.48
TP53BP1 Q12888 2/20 0.47
MBTD1 Q05BQ5 1/20 0.47
L3MBTL4 Q8NA19 1/20 0.47
CYP2D6 P10635 1/20 0.46

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
SCHEMBL1788410 0.88 KDM2B (0.55) HRH3ALDH1A1L3MBTL3L3MBTL1KDM2B
SCHEMBL1791391 0.85 HRH3 (0.57) HRH3ALDH1A1SMN1; SMN2L3MBTL3L3MBTL1
SCHEMBL1789789 0.84 HRH3 (0.65) HRH3L3MBTL3L3MBTL1KDM2BTP53BP1
SCHEMBL1787573 0.84 HRH3 (0.62) HRH3L3MBTL3L3MBTL1KDM2BTP53BP1
SCHEMBL1790933 0.82 HRH3 (0.56) HRH3L3MBTL3L3MBTL1KDM2BTP53BP1
SCHEMBL1787138 0.81 ALDH1A1 (0.52) ALDH1A1SMN1; SMN2L3MBTL1CYP2D6
SCHEMBL1790897 0.81 HRH3 (0.76) HRH3L3MBTL3L3MBTL1KDM2BCYP2D6
SCHEMBL1791338 0.80 HRH3 (0.61) HRH3ALDH1A1L3MBTL3L3MBTL1KDM2B
SCHEMBL1790480 0.78 HRH3 (0.54) HRH3L3MBTL3L3MBTL1KDM2BTP53BP1
SCHEMBL4528427 0.76 HRH3 (0.56) HRH3L3MBTL3L3MBTL1KDM2BTP53BP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2326625-A1 BENZAZEPINE DERIVATIVES AND THEIR USE AS HSTAMINE H3 ANTAGONISTS Takeda Pharmaceutical Company Limited (JP) 2011-06-01 EP disclosed
US-20110124626-A1 BENZAZEPINE DERIVATIVES AND THEIR USE AS HISTAMINE H3 ANTAGONISTS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-05-26 US disclosed
US-20110124626-A1 BENZAZEPINE DERIVATIVES AND THEIR USE AS HISTAMINE H3 ANTAGONISTS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-05-26 US disclosed
US-20110124626-A1 BENZAZEPINE DERIVATIVES AND THEIR USE AS HISTAMINE H3 ANTAGONISTS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-05-26 US disclosed
WO-2010007382-A1 BENZAZEPINE DERIVATIVES AND THEIR USE AS HSTAMINE H3 ANTAGONISTS TAKEDA PHARMACEUTICAL COMPANY LIMITED. (JP) 2010-01-21 WO disclosed
WO-2010007382-A1 BENZAZEPINE DERIVATIVES AND THEIR USE AS HSTAMINE H3 ANTAGONISTS TAKEDA PHARMACEUTICAL COMPANY LIMITED. (JP) 2010-01-21 WO 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-20110124626-A1 BENZAZEPINE DERIVATIVES AND THEIR USE AS HISTAMINE H3 ANTAGONISTS HRH4, HRH3, HRH2 HRH3 2/4885ALDH1A1 1526/4885SMN1; SMN2 4393/4885

“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.