SCHEMBL8088915

SCHEMBL8088915

Cc1cc(OC2CCN(Cc3ccc(O)c(O)c3)CC2)c2ccccc2n1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR1D P28221 8/20 0.51
HTR1B P28222 6/20 0.50
HTR1A P08908 4/20 0.47
NCF1 P14598 1/20 0.46
SSTR5 P35346 4/20 0.44
ENPP2 Q13822 3/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
TRPV6 Q9H1D0 1/20 0.42

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
SCHEMBL5532963 0.88 NCF1 (0.58) HTR1DHTR1BHTR1ANCF1SMN1; SMN2
SCHEMBL8091683 0.88 HTR1D (0.51) HTR1DHTR1BHTR1ANCF1ENPP2
SCHEMBL5529815 0.86 NCF1 (0.51) HTR1DHTR1BHTR1ANCF1SMN1; SMN2
SCHEMBL5531742 0.86 SSTR5 (0.54) HTR1DHTR1BHTR1ASSTR5
SCHEMBL5529129 0.85 HTR1D (0.52) HTR1DHTR1BHTR1ANCF1SSTR5
SCHEMBL13945423 0.85 HTR1D (0.50) HTR1DHTR1BHTR1ANCF1SSTR5
SCHEMBL5531659 0.84 HTR1D (0.57) HTR1DHTR1BHTR1ANCF1SSTR5
SCHEMBL14437441 0.84 NCF1 (0.51) HTR1DHTR1BHTR1ANCF1SMN1; SMN2
SCHEMBL8235825 0.84 HTR1D (0.49) HTR1DHTR1BHTR1ANCF1ENPP2
SCHEMBL13945359 0.84 HTR1D (0.51) HTR1DHTR1BHTR1ANCF1SMN1; SMN2

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
US-20090023773-A1 COMPOSITIONS AND METHODS FOR MODULATING GATED ION CHANNELS PAINCEPTOR PHARMA CORPORATION (CA) 2009-01-22 US disclosed
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 HTR1D 483/4885HTR1B 354/4885HTR1A 390/4885

“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.