SCHEMBL4768342

SCHEMBL4768342

O=C(Nc1ccc2c(c1)CCN(C1CCC1)CC2)c1cnccc1C(F)(F)F

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 11/20 0.45
SLC2A1 P11166 2/20 0.44
TP53 P04637 3/20 0.43
NPC1 O15118 2/20 0.43
HTT P42858 2/20 0.43
RAB9A P51151 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
HRH1 P35367 1/20 0.41
PTGES O14684 1/20 0.41
MAPT P10636 1/20 0.40
NFKB1 P19838 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
LMNA P02545 1/20 0.40
RBP4 P02753 1/20 0.40
CRACR2A Q9BSW2 1/20 0.40

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
SCHEMBL4772451 0.86 TP53 (0.53) TP53NPC1HTTRAB9ASMN1; SMN2
SCHEMBL4765395 0.85 HRH3 (0.49) HRH3TP53NPC1HTTRAB9A
Trifluoroacetic Acid SCHEMBL4765765 0.83 TP53 (0.50) HRH3SLC2A1TP53NPC1HTT
SCHEMBL4768020 0.80 SLC2A1 (0.53) HRH3SLC2A1TP53NPC1HTT
SCHEMBL4770989 0.79 SMN1; SMN2 (0.71) HRH3TP53NPC1HTTRAB9A
SCHEMBL4767429 0.79 RAB9A (0.55) HRH3TP53NPC1HTTRAB9A
SCHEMBL4768203 0.79 TRPV4 (0.59) HRH3SLC2A1TP53NPC1HTT
SCHEMBL4765325 0.79 HRH3 (0.45) HRH3TP53NPC1HTTRAB9A
SCHEMBL4775548 0.78 LMNA (0.54) HRH3TP53NPC1HTTRAB9A
SCHEMBL4765222 0.78 HRH3 (0.52) HRH3RAB9ASMN1; SMN2MAPT

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-1713778-B1 BENZAZEPINE DERIVATIVES AS HISTAMINE H3 ANTAGONISTS GLAXO GROUP LTD (GB) 2008-01-16 EP claimed
US-20070060566-A1 Benzazepine derivatives as histamine h3 antagonists GLAXO GROUP LIMITED (GB) 2007-03-15 US claimed
EP-1713778-B1 BENZAZEPINE DERIVATIVES AS HISTAMINE H3 ANTAGONISTS GLAXO GROUP LTD (GB) 2008-01-16 EP 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-20070060566-A1 Benzazepine derivatives as histamine h3 antagonists HRH3, HRH4, HRH1 HRH3 1/4885SLC2A1 4665/4885TP53 4863/4885

“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.