SCHEMBL1790237

SCHEMBL1790237

CC(C)(O)C(=O)NCc1ccc2c(c1)CCN(C1=CC=C1)CC2

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 1/20 0.37
TP53 P04637 3/20 0.36
TRPV1 Q8NER1 6/20 0.36
LMNA P02545 4/20 0.35
MAPK14 Q16539 1/20 0.35
THRB P10828 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
IDO1 P14902 1/20 0.33
DRD2 P14416 1/20 0.33

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
SCHEMBL1787586 0.87 LMNA (0.39) TP53TRPV1LMNATHRB
SCHEMBL1790034 0.84 LMNA (0.41) TP53LMNATHRB
SCHEMBL1789814 0.83 ERCC1 (0.47) TP53TRPV1LMNAMAPK14IDO1
SCHEMBL1788201 0.81 MEN1 (0.46) TP53TRPV1LMNATHRBIDO1
SCHEMBL1789972 0.81 KMT2A (0.42) LMNAMAPK14
SCHEMBL1791796 0.80 KMT2A (0.41) MAPK14
SCHEMBL1790155 0.79 POLB (0.45) TP53LMNAMAPK14IDO1
SCHEMBL1789875 0.78 TP53 (0.44) TP53LMNAMAPK14THRB
SCHEMBL1791978 0.78 KMT2A (0.48) LMNA
SCHEMBL1790517 0.78 LMNA (0.51) TP53LMNAMAPK14THRB

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 3 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
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 CYP11B2 1282/4885TP53 4800/4885TRPV1 395/4885

“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.