SCHEMBL1787588

SCHEMBL1787588

Cn1c(CNC(=O)c2ccc3c(c2)CCN(C2CCC2)CC3)nc2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.47
OGFRL1 Q5TC84 2/20 0.46
OPRM1 P35372 1/20 0.46
OPRD1 P41143 1/20 0.46
OPRK1 P41145 1/20 0.46
HRH3 Q9Y5N1 4/20 0.46
GAA P10253 1/20 0.45
KMT2A Q03164 3/20 0.44
LMNA P02545 1/20 0.44
MEN1 O00255 2/20 0.44
HTT P42858 1/20 0.43
PRMT5 O14744 2/20 0.43
WDR77 Q9BQA1 2/20 0.43
HDAC6 Q9UBN7 2/20 0.42
TP53 P04637 1/20 0.42

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
SCHEMBL1787589 0.82 MAPT (0.47) MAPTGAAKMT2ALMNAMEN1
SCHEMBL1789818 0.81 ROCK2 (0.51) MAPTOGFRL1OPRM1OPRD1OPRK1
SCHEMBL1787962 0.80 HRH3 (0.46) OGFRL1OPRM1OPRD1OPRK1HRH3
SCHEMBL1788806 0.79 HRH3 (0.54) MAPTHRH3KMT2ALMNAMEN1
SCHEMBL1789085 0.79 SMN1; SMN2 (0.54) MAPTKMT2AHDAC6
SCHEMBL1789634 0.77 HRH3 (0.57) MAPTHRH3LMNAHTT
SCHEMBL1791545 0.77 HRH3 (0.48) MAPTHRH3HDAC6
SCHEMBL1788605 0.77 HRH3 (0.50) HRH3HDAC6
SCHEMBL1790042 0.77 KDM4E (0.52) MAPTHRH3KMT2ALMNAMEN1
SCHEMBL1787941 0.77 HRH3 (0.50) MAPTHRH3HDAC6

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 MAPT 3598/4885OGFRL1 164/4885OPRM1 7/4885

“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.