SCHEMBL5680208

SCHEMBL5680208

CNC1Cc2ccc(C)cc2C1O

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TRPM5 Q9NZQ8 2/20 0.38
HTR1A P08908 1/20 0.37
CNR1 P21554 1/20 0.35
ACHE P22303 1/20 0.34
DRD5 P21918 2/20 0.34
AADAT Q8N5Z0 1/20 0.33
PYGL P06737 2/20 0.32
DRD2 P14416 1/20 0.32
DRD1 P21728 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32
CHRNB2 P17787 1/20 0.32
CHRNA4 P43681 1/20 0.32
KMT2A Q03164 1/20 0.31

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
SCHEMBL5680209 1.00 TRPM5 (0.38) TRPM5HTR1ACNR1ACHEDRD5
SCHEMBL5677085 0.86 TRPM5 (0.38) TRPM5HTR1ACNR1ACHEDRD5
SCHEMBL5677082 0.86 TRPM5 (0.38) TRPM5HTR1ACNR1ACHEDRD5
SCHEMBL11895988 0.82 CNR1 (0.43) TRPM5HTR1ACNR1ACHEPYGL
SCHEMBL5676943 0.79 OPRM1 (0.45) HTR1AACHEDRD2
SCHEMBL5675691 0.77 SIGMAR1 (0.44) CNR1DRD5PYGLSLC6A2SLC6A4
SCHEMBL5680214 0.77 SIGMAR1 (0.44) CNR1DRD5PYGLSLC6A2SLC6A4
SCHEMBL5675575 0.77 SIGMAR1 (0.44) CNR1DRD5PYGLSLC6A2SLC6A4
SCHEMBL5675579 0.77 SIGMAR1 (0.44) CNR1DRD5PYGLSLC6A2SLC6A4
SCHEMBL27145561 0.77 TRPM5 (0.41) TRPM5HTR1AACHEAADATDRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1414426-B1 CARBOCYCLIC HYDRAZINO INHIBITORS OF COPPER-CONTAINING AMINE OXIDASES BIOTIE THERAPIES CORP (FI) 2006-03-01 EP disclosed
US-20040236108-A1 Carbocyclic hydrazino inhibitors of copper-containing amine oxidases BIOTIE THERAPIES CORPORATION (FI) 2004-11-25 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-20040236108-A1 Carbocyclic hydrazino inhibitors of copper-containing amine oxidases AOC2, VCAM1, AOC3 TRPM5 3229/4885HTR1A 2571/4885CNR1 1276/4885

“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.