SCHEMBL5664487

SCHEMBL5664487

CC(C)(C)OC(=O)N1CCc2ccc(Cc3ccc(N4CCCC4=O)cc3)cc2CC1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.49
ESR2 Q92731 1/20 0.47
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
HPGD P15428 4/20 0.43
LMNA P02545 4/20 0.42
TSHR P16473 2/20 0.42
GALR3 O60755 1/20 0.42
HTT P42858 1/20 0.42
USP2 O75604 1/20 0.42
ALDH1A1 P00352 3/20 0.41
POLB P06746 1/20 0.41
MPO P05164 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
DDB1 Q16531 1/20 0.39
CRBN Q96SW2 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL5181709 0.85 NR1H2 (0.45) NR1H2ESR2NPC1RAB9AMPO
SCHEMBL5170947 0.84 ESR2 (0.52) NR1H2ESR2NPC1RAB9ALMNA
SCHEMBL20929548 0.83 NR1H2 (0.65) NR1H2ESR2NPC1RAB9AHPGD
SCHEMBL5662155 0.82 ESR2 (0.53) NR1H2ESR2NPC1RAB9A
SCHEMBL5662905 0.82 NR1H2 (0.44) NR1H2ESR2NPC1RAB9AMPO
SCHEMBL5661604 0.80 ESR2 (0.50) NR1H2ESR2NPC1RAB9AALDH1A1
SCHEMBL5663555 0.79 GPR119 (0.49) NR1H2ESR2NPC1RAB9AMEN1
SCHEMBL1787313 0.78 ESR2 (0.59) NR1H2ESR2NPC1RAB9AUSP2
SCHEMBL3872052 0.78 ESR2 (0.56) NR1H2ESR2NPC1RAB9AHPGD
SCHEMBL1788257 0.77 ESR2 (0.57) NR1H2ESR2NPC1RAB9AUSP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070208005-A1 TETRAHYDROBENZAZEPINES AS ANTAGONISTS AND/OR REVERSE AGONISTS OF THE HISTAMINE H3 RECEPTOR GLAXO GROUP LIMITED (GB) 2007-09-06 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-20070208005-A1 TETRAHYDROBENZAZEPINES AS ANTAGONISTS AND/OR REVERSE AGONISTS OF THE HISTAMINE H3 RECEPTOR HRH3, HRH4, HRH1 NR1H2 354/4885ESR2 938/4885NPC1 1849/4885

“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.