SCHEMBL8096407

SCHEMBL8096407

Cc1cc(OC2CCN(Cc3c(F)cccc3C#N)CC2)c2cc(C#N)ccc2n1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 4/20 0.40
HRH3 Q9Y5N1 2/20 0.40
GLP1R P43220 1/20 0.38
GPR6 P46095 9/20 0.37
RORC P51449 1/20 0.37
HTR1D P28221 1/20 0.37
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36

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
SCHEMBL8096393 0.91 CHRM4 (0.40) CHRM4HRH3HTR1D
SCHEMBL8100848 0.86 HRH3 (0.44) CHRM4HRH3GPR6HTR1DMAOA
SCHEMBL13945390 0.86 AR (0.39) CHRM4HRH3
SCHEMBL8095794 0.84 HRH3 (0.58) HRH3HTR1DMAOAMAOB
SCHEMBL8087938 0.82 CHRM4 (0.38) CHRM4GPR6
SCHEMBL4242392 0.80 CHRM4 (0.49) CHRM4HRH3HTR1D
SCHEMBL8095832 0.79 HRH3 (0.50) CHRM4HRH3GPR6HTR1DMAOA
SCHEMBL5531637 0.77 HRH3 (0.51) HRH3GPR6HTR1D
SCHEMBL13969375 0.76 HTR1D (0.42) CHRM4HRH3HTR1D
SCHEMBL5532964 0.76 HRH3 (0.58) HRH3HTR1DMAOAMAOB

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
US-20090023773-A1 COMPOSITIONS AND METHODS FOR MODULATING GATED ION CHANNELS PAINCEPTOR PHARMA CORPORATION (CA) 2009-01-22 US disclosed
WO-2009000085-A1 QUINOLINE AND QUINAZOLINE DERIVATIVES USEFUL AS MODULATORS OF GATED ION CHANNELS PAINCEPTOR PHARMA CORPORATION (CA) 2008-12-31 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-20090023773-A1 COMPOSITIONS AND METHODS FOR MODULATING GATED ION CHANNELS TRPV1, TRPV2, TRPA1 CHRM4 413/4885HRH3 1043/4885GLP1R 1977/4885

“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.