SCHEMBL4133474

SCHEMBL4133474

CC1CCCN1C1CCc2cc(-c3cccc([N+](=O)[O-])c3)ccc2C1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 2/20 0.46
ACHE P22303 1/20 0.42
TDP2 O95551 2/20 0.41
MAPK1 P28482 1/20 0.41
PGR P06401 5/20 0.40
CHRNB4 P30926 2/20 0.39
CHRNA3 P32297 2/20 0.39
CHRNB1 P11230 1/20 0.39
CHRNB2 P17787 1/20 0.39
CHRNB3 Q05901 1/20 0.39
KMT2A Q03164 1/20 0.38
ALDH1A1 P00352 2/20 0.37
LAP3 P28838 1/20 0.37
KDM4E B2RXH2 1/20 0.37
MAPT P10636 1/20 0.37
ADORA1 P30542 1/20 0.37

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
SCHEMBL4136971 0.84 USP30 (0.47) USP30TDP2PGRCHRNB4CHRNA3
SCHEMBL4129121 0.83 HRH3 (0.39) USP30
SCHEMBL4136602 0.83 ALDH1A1 (0.39) ALDH1A1MAPT
SCHEMBL4142343 0.83 HRH3 (0.40) USP30
SCHEMBL4141100 0.82 HRH3 (0.38) KMT2A
SCHEMBL4135773 0.81 CYP11B1 (0.37) TDP2
SCHEMBL4132406 0.81 MCHR1 (0.37)
SCHEMBL4136466 0.80 PDE4A (0.43) USP30TDP2ALDH1A1
SCHEMBL4136097 0.80 TMEM97 (0.46) ALDH1A1
SCHEMBL4135535 0.80 ASIC3 (0.35)

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-20090163482-A1 TETRALINES ANTAGONISTS OF THE H-3 RECEPTOR MCHARDY STANTON FURST 2009-06-25 US claimed

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-20090163482-A1 TETRALINES ANTAGONISTS OF THE H-3 RECEPTOR HRH3, HRH4, HRH1 USP30 3191/4885ACHE 638/4885TDP2 2982/4885

“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.